data_2m0g_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 2m0g _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 12' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 . . . . . 0 CA--C 1.527 0.074 0 N-CA-C 110.154 -0.314 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -56.66 115.57 2.57 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.998 2.465 . . . . 0.0 112.34 -177.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.73 1.32 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.833 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.88 12.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.38 -36.22 3.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.984 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.74 91.89 2.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.894 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.89 -54.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.838 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.85 111.21 13.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.973 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.02 125.58 24.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.755 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.76 19.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.009 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.515 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.9 m95 -141.97 53.02 1.48 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.782 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.23 -156.57 0.13 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.879 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.465 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.27 -37.72 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.87 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.76 122.69 47.17 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.593 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.373 0 O-C-N 124.03 0.831 . . . . 0.0 110.399 176.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 C--O 1.232 0.145 0 CA-C-O 121.219 0.533 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.461 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 71.5 p -119.1 162.3 18.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.159 176.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.404 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.72 -31.42 72.34 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 120.896 0.379 . . . . 0.0 111.334 -178.239 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.461 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.3 -45.21 61.01 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.08 -33.45 73.55 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.749 -177.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.22 -46.32 88.77 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.998 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -63.18 -43.36 98.44 Favored 'General case' 0 C--O 1.185 -2.316 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.229 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.427 ' HA ' HG23 ' A' ' 54' ' ' VAL . . . -58.39 -41.41 84.81 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.765 0.666 . . . . 0.0 111.602 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -66.99 -42.79 84.44 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.024 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.689 HG23 HG23 ' B' ' 460' ' ' VAL . 96.6 mt -66.25 -49.14 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.768 177.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.427 HG23 ' HA ' ' A' ' 51' ' ' ALA . 35.0 m -65.57 -35.65 75.75 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.931 -176.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.11 -44.39 91.99 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.491 0.587 . . . . 0.0 110.372 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.3 tp -62.67 -42.01 99.39 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.807 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.521 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 43.0 mt-30 -68.78 -35.67 77.34 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.641 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 54' ' ' VAL . 73.3 mt -62.83 -47.0 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.431 178.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.35 -41.81 84.52 Favored 'General case' 0 CA--C 1.513 -0.47 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.701 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.26 -33.15 73.83 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.441 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.526 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.1 -44.94 78.72 Favored 'General case' 0 C--O 1.207 -1.159 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 173.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.0 m -65.55 -35.79 81.88 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.469 ' O ' HG21 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.72 -42.83 75.89 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 122.089 0.947 . . . . 0.0 108.531 176.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.526 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.2 ttmt -61.75 -47.75 83.8 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 113.773 -1.558 . . . . 0.0 111.921 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.17 -28.89 63.51 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.788 -0.765 . . . . 0.0 111.863 177.01 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.95 -47.16 69.41 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.469 HG21 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.1 -17.52 14.46 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.966 -0.694 . . . . 0.0 112.853 -177.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.45 10.76 Favored Glycine 0 C--N 1.316 -0.53 0 C-N-CA 119.857 -1.163 . . . . 0.0 111.268 -177.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.43 91.37 6.84 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.233 0.539 . . . . 0.0 110.171 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.4 tp . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 178.672 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.435 -1.186 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.1 -52.58 16.12 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.257 -0.902 . . . . 0.0 109.661 -178.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.5 mp0 -53.23 -51.77 61.1 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.623 -1.626 . . . . 0.0 110.667 -178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -66.68 -38.68 87.29 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 113.466 -1.697 . . . . 0.0 110.659 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.516 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.9 -44.54 94.19 Favored 'General case' 0 CA--C 1.511 -0.538 0 O-C-N 123.22 0.325 . . . . 0.0 110.402 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.702 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.4 m -68.95 -50.07 52.42 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.703 178.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.34 -41.37 93.99 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.99 -39.15 90.08 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 100' ' ' ARG . 6.2 tmtt? -60.19 -40.11 88.9 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.98 -41.05 97.64 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.657 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.02 -34.33 78.18 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.824 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.37 74.3 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 177.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.43 -48.86 76.03 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 175.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.536 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.29 -45.53 94.09 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.405 179.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.21 -37.42 85.28 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.564 0.746 . . . . 0.0 111.044 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.84 -43.75 86.07 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.411 HD12 ' HB2' ' A' ' 57' ' ' GLN . 65.6 mt -72.22 -38.58 68.96 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.768 177.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.47 -50.87 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 110.489 -0.189 . . . . 0.0 110.489 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.7 m -60.68 -39.5 88.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.277 0.561 . . . . 0.0 110.557 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.597 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.94 -49.6 60.86 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.005 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.37 -37.12 84.57 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.8 t -65.53 -36.81 78.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.17 0.509 . . . . 0.0 109.644 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.73 80.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.23 0.538 . . . . 0.0 110.25 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.6 mt -71.45 -40.61 70.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.023 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.63 111.2 12.47 Favored Pre-proline 0 C--N 1.317 -0.826 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.936 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.74 -22.66 36.88 Favored 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 122.8 2.334 . . . . 0.0 112.57 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.34 0.13 55.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.101 -177.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.97 134.68 54.44 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.616 -178.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.41 109.11 62.83 Favored Pre-proline 0 CA--C 1.509 -0.614 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.274 177.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.24 157.89 59.85 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 122.303 2.002 . . . . 0.0 111.485 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.55 154.51 24.73 Favored 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 123.603 2.868 . . . . 0.0 111.777 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.06 -32.41 72.74 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 -173.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -73.82 -24.92 59.86 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 123.895 0.747 . . . . 0.0 110.951 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 46.1 t80 . . . . . 0 N--CA 1.454 -0.256 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.295 175.21 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo . . . . . 0 N--CA 1.473 0.284 0 CA-C-O 121.411 0.505 . . . . 0.0 113.358 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 375' ' ' THR . . . . . 0.448 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -117.77 -71.38 0.74 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.119 179.892 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 376' ' ' GLU . . . . . 0.484 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.91 0.01 OUTLIER 'General case' 0 C--O 1.232 0.136 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 377' ' ' VAL . . . . . 0.45 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.66 150.97 7.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.431 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 378' ' ' LEU . . . . . 0.456 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.59 152.51 20.86 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.246 -179.086 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 379' ' ' CYS . . . . . 0.56 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.55 142.61 46.49 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.567 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . 0.414 ' HB3' ' SD ' ' B' ' 383' ' ' MET . 5.4 mt -132.79 103.13 5.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.968 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 381' ' ' MET . . . . . 0.507 ' HE3' ' HE2' ' B' ' 431' ' ' LYS . 10.3 ttt -116.86 162.79 17.17 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.194 -176.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.58 51.25 8.09 Favored 'General case' 0 C--N 1.342 0.262 0 O-C-N 123.208 0.318 . . . . 0.0 111.275 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 383' ' ' MET . . . . . 0.414 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.92 14.39 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.259 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 384' ' ' VAL . . . . . 0.484 HG12 HD11 ' B' ' 398' ' ' ILE . 0.4 OUTLIER -152.3 125.11 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.83 0.347 . . . . 0.0 111.354 179.863 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . . . . . . . . . 20.1 mt -110.69 151.77 43.04 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.428 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.12 -23.53 73.29 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.307 2.005 . . . . 0.0 112.315 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.85 -5.48 53.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.559 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.07 -36.7 5.78 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.901 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 389' ' ' LEU . . . . . 0.459 HD12 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.91 0.46 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 390' ' ' LEU . . . . . 0.521 HD21 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.53 -15.73 5.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.663 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -98.28 148.77 23.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.574 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -73.52 -30.26 62.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.21 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -75.37 -47.65 26.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.728 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.57 -44.27 91.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.768 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -56.4 -59.34 5.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.249 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.3 61.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.194 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.1 -41.04 67.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.412 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 398' ' ' ILE . . . . . 0.484 HD11 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.89 -53.67 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.517 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 399' ' ' VAL . . . . . 0.58 HG22 HD11 ' B' ' 417' ' ' ILE . 59.6 t -53.34 -46.91 58.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.814 -179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.99 3.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.486 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.63 -57.13 11.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.389 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.15 -32.9 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.33 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 403' ' ' ARG . . . . . 0.442 ' HA ' HD13 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.2 -57.41 4.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.706 0.288 . . . . 0.0 111.116 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.98 -33.57 64.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.162 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 405' ' ' GLU . . . . . 0.515 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.5 -47.04 44.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.942 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.89 -23.88 67.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.144 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.12 30.38 1.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.961 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.13 -17.17 12.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.863 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.41 14.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.574 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.14 -139.4 4.14 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.586 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 411' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.22 132.4 56.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.678 0.275 . . . . 0.0 111.101 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.36 115.43 48.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.01 0.433 . . . . 0.0 110.692 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . 0.605 ' HG3' HG21 ' B' ' 437' ' ' THR . 10.9 mttt -56.63 -61.95 2.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.186 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.02 -169.4 3.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.088 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 415' ' ' ILE . . . . . 0.577 HG21 HG13 ' B' ' 434' ' ' VAL . 48.7 mt -145.12 128.98 12.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.833 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 416' ' ' GLU . . . . . 0.416 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.87 108.8 18.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.667 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 417' ' ' ILE . . . . . 0.607 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.9 mt -128.56 108.6 18.99 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.625 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 418' ' ' PRO . . . . . 0.669 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.6 Cg_endo -48.56 147.65 9.11 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.667 2.245 . . . . 0.0 112.866 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 419' ' ' ARG . . . . . 0.521 HH21 HD21 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.93 74.73 21.73 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.149 179.854 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -47.15 117.05 2.0 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.728 2.285 . . . . 0.0 112.491 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 421' ' ' VAL . . . . . 0.517 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.2 t -74.36 97.77 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.186 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.65 21.77 9.14 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.479 0.657 . . . . 0.0 109.32 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 423' ' ' GLY . . . . . 0.549 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.26 29.26 6.1 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.328 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 424' ' ' VAL . . . . . 0.517 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.51 -37.45 30.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.94 35.9 4.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 111.776 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 426' ' ' VAL . . . . . 0.659 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.33 -44.74 48.12 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.783 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 427' ' ' PRO . . . . . 0.659 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.29 77.08 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.497 2.131 . . . . 0.0 111.095 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.3 -15.39 3.22 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.359 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.3 t -67.54 149.38 50.22 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.573 0.225 . . . . 0.0 110.82 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.51 -14.2 5.06 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.814 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 431' ' ' LYS . . . . . 0.507 ' HE2' ' HE3' ' B' ' 381' ' ' MET . 0.0 OUTLIER -125.43 126.13 44.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.871 0.367 . . . . 0.0 111.092 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 432' ' ' ILE . . . . . 0.669 HG22 ' HD2' ' B' ' 418' ' ' PRO . 7.8 pt -131.05 172.87 15.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.232 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 433' ' ' PHE . . . . . 0.56 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.33 2.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.958 0.409 . . . . 0.0 112.015 -178.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 434' ' ' VAL . . . . . 0.577 HG13 HG21 ' B' ' 415' ' ' ILE . 3.3 m -135.86 141.68 41.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.18 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 435' ' ' GLU . . . . . 0.48 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.31 108.48 17.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.841 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.7 168.42 12.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.234 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 437' ' ' THR . . . . . 0.605 HG21 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -95.02 -45.34 7.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.439 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.94 146.62 52.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 111.198 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.26 -12.7 16.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.248 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.9 24.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.098 0.475 . . . . 0.0 110.078 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -75.07 -29.52 60.71 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.842 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.16 -31.74 72.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.209 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.72 -47.99 15.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.622 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.1 59.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.709 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.79 -55.76 3.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 446' ' ' MET . . . . . . . . . . . . . 4.2 ptm -63.64 -27.7 69.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.297 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.51 -16.26 63.41 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.632 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.65 -8.58 22.52 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.374 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.2 mt -95.71 -19.02 20.02 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.813 0.34 . . . . 0.0 110.969 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 3.6 t -74.37 131.1 40.82 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.989 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.53 -9.65 73.73 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.23 178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -76.41 -152.23 0.04 OUTLIER 'General case' 0 C--N 1.339 0.133 0 CA-C-N 117.327 0.564 . . . . 0.0 110.495 178.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 453' ' ' LYS . . . . . 0.465 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.79 117.12 2.29 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.811 0.338 . . . . 0.0 111.292 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.2 -36.4 75.29 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.545 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.824 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.29 24.93 0.3 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.771 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 457' ' ' ARG . . . . . 0.409 ' NE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.5 135.3 18.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.279 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 46.3 t -63.38 122.44 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.42 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 59.4 t -76.62 121.28 28.49 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.714 -177.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 460' ' ' VAL . . . . . 0.689 HG23 HG23 ' A' ' 53' ' ' ILE . 65.5 t -89.79 96.94 6.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.364 176.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 10.3 t -91.04 153.54 20.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.661 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 462' ' ' LYS . . . . . 0.413 ' HE3' ' HB3' ' B' ' 462' ' ' LYS . 2.0 ttpp -159.18 -167.52 2.09 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 121.106 0.479 . . . . 0.0 110.76 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -114.21 146.99 39.65 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 123.385 0.674 . . . . 0.0 110.452 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 464' ' ' CYS . . . . . 0.45 ' O ' HG21 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.91 149.02 47.36 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.104 0.478 . . . . 0.0 111.286 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 465' ' ' ASP . . . . . 0.448 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.39 129.34 66.67 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.372 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 466' ' ' PRO . . . . . 0.484 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.04 -33.32 72.84 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.75 2.3 . . . . 0.0 112.097 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.97 -58.52 7.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.441 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.36 -33.78 68.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.336 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 469' ' ' TYR . . . . . 0.48 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.0 -51.27 70.39 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.21 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.36 -47.51 69.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.367 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 471' ' ' ARG . . . . . 0.451 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.13 49.35 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.44 -179.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.73 8.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.942 0.401 . . . . 0.0 110.269 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 473' ' ' ASP . . . . . 0.451 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.81 -20.54 23.17 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.006 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 . . . . . 0 N--CA 1.476 0.836 0 C-N-CA 122.92 0.488 . . . . 0.0 112.017 179.027 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 . . . . . 0 C--O 1.231 0.091 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -56.38 115.48 2.5 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 123.1 2.533 . . . . 0.0 112.458 -174.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.71 1.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.846 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.38 51.93 12.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.913 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.37 -36.24 3.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.992 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.71 91.86 2.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.86 -54.26 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.83 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.79 111.2 13.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.039 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.05 125.6 25.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.693 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 21' ' ' ARG . 0.9 OUTLIER -112.58 12.75 19.92 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.01 -179.805 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.522 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.9 m95 -141.98 53.11 1.48 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.731 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -156.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.84 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.472 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.37 -37.6 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.91 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.65 113.49 24.41 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.246 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.8 t . . . . . 0 N--CA 1.477 0.886 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -175.317 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.655 0.264 . . . . 0.0 111.593 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 48.5 p -77.56 157.92 30.1 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 173.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.621 ' HB2' ' HZ3' ' B' ' 431' ' ' LYS . 0.0 OUTLIER -63.36 -31.32 72.44 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 120.856 0.36 . . . . 0.0 111.319 -173.511 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -72.38 -45.04 61.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.3 -32.83 72.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.735 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 46' ' ' ARG . 20.2 pt-20 -66.84 -38.3 86.13 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.028 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.447 ' O ' HG21 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.99 -43.34 96.01 Favored 'General case' 0 C--O 1.185 -2.338 0 CA-C-O 118.877 -0.583 . . . . 0.0 110.25 174.443 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.447 ' HA ' HG21 ' A' ' 54' ' ' VAL . . . -58.43 -41.95 86.21 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 123.794 0.684 . . . . 0.0 111.597 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -64.21 -48.12 77.08 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.834 175.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.695 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 63.5 mt -60.61 -51.8 68.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 120.872 0.368 . . . . 0.0 110.802 177.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.447 HG21 ' HA ' ' A' ' 51' ' ' ALA . 35.0 m -64.77 -35.62 75.48 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.789 0 CA-C-O 118.67 -0.681 . . . . 0.0 111.919 -174.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.01 -44.31 91.66 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.566 0.621 . . . . 0.0 110.317 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 2.2 pp -71.35 -28.19 63.89 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.884 179.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.599 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 14.2 mm-40 -74.51 -36.25 63.22 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 174.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.473 HD11 HD13 ' A' ' 113' ' ' ILE . 72.9 mt -63.21 -46.97 94.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.404 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.503 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.49 -40.86 85.22 Favored 'General case' 0 CA--C 1.513 -0.476 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.7 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -71.67 -30.25 65.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.321 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.51 -44.93 77.22 Favored 'General case' 0 C--O 1.208 -1.131 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 171.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.62 -35.79 81.82 Favored 'General case' 0 N--CA 1.432 -1.343 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.48 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.84 -42.7 76.16 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 176.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.81 -47.82 83.38 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 113.856 -1.52 . . . . 0.0 111.848 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.12 -28.91 63.58 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.883 177.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -67.98 -47.14 69.38 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.1 -17.49 14.47 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.916 0.709 . . . . 0.0 112.916 -177.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.47 10.73 Favored Glycine 0 C--N 1.316 -0.565 0 C-N-CA 119.884 -1.151 . . . . 0.0 111.29 -177.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.39 91.42 6.83 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.229 0.538 . . . . 0.0 110.24 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.626 177.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.436 -1.154 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.1 -52.5 16.47 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.226 -0.922 . . . . 0.0 109.659 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -53.32 -51.7 61.55 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 113.677 -1.602 . . . . 0.0 110.659 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -66.73 -38.63 87.05 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.498 -1.683 . . . . 0.0 110.678 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.95 -44.55 94.33 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.177 0.298 . . . . 0.0 110.307 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.689 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.8 m -69.01 -49.99 52.77 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.691 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.43 -41.28 93.7 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -175.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.0 -39.07 89.98 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.29 -40.14 89.41 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.91 -41.01 97.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.736 178.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.11 -34.35 78.19 Favored 'General case' 0 C--O 1.21 -1.009 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.712 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.44 -34.34 74.27 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 177.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.54 -48.75 76.24 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 175.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.54 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.35 -45.51 94.08 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.392 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . 0.418 ' NE2' ' HH ' ' A' ' 129' ' ' TYR . 14.4 t-160 -62.27 -37.37 85.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.017 -178.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.91 -43.7 86.34 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 177.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.473 HD11 ' HB2' ' A' ' 57' ' ' GLN . 65.4 mt -72.28 -38.53 68.77 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.75 177.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.54 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.38 -50.85 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 120.514 0.197 . . . . 0.0 110.544 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 96.2 m -60.81 -39.46 89.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.148 0.499 . . . . 0.0 110.477 -179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.598 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.57 60.93 Favored 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.03 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.32 -37.08 84.56 Favored 'General case' 0 C--O 1.217 -0.621 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.0 t -65.59 -36.88 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.59 -40.76 80.35 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.162 0.505 . . . . 0.0 110.211 177.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 67.0 mt -71.49 -40.61 70.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.995 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.56 111.14 12.54 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.001 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -68.72 -22.69 36.94 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 122.805 2.337 . . . . 0.0 112.56 -178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.33 0.14 55.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.336 0.589 . . . . 0.0 111.121 -177.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.96 134.61 54.31 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.651 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.32 109.16 62.89 Favored Pre-proline 0 N--CA 1.446 -0.642 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.332 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.28 157.98 59.49 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.228 1.952 . . . . 0.0 111.473 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.66 154.47 25.47 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 123.598 2.865 . . . . 0.0 111.737 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.06 -30.25 69.4 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -173.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -73.59 -25.27 60.26 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.851 0.719 . . . . 0.0 111.791 -174.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . 0.418 ' HH ' ' NE2' ' A' ' 110' ' ' HIS . 42.4 t80 . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.723 0.297 . . . . 0.0 110.39 177.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo . . . . . 0 CA--C 1.53 0.309 0 N-CA-C 113.586 0.571 . . . . 0.0 113.586 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 375' ' ' THR . . . . . 0.449 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -129.01 -71.32 0.64 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.121 176.883 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 376' ' ' GLU . . . . . 0.483 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.88 -45.92 0.01 OUTLIER 'General case' 0 C--O 1.232 0.172 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 377' ' ' VAL . . . . . 0.444 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.72 151.02 7.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.423 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 378' ' ' LEU . . . . . 0.445 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.7 152.57 20.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.207 -179.014 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 379' ' ' CYS . . . . . 0.571 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.7 t -115.56 142.61 46.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.641 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . 0.418 ' HB3' ' SD ' ' B' ' 383' ' ' MET . 5.4 mt -132.73 101.49 5.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.979 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 381' ' ' MET . . . . . 0.446 ' HE2' ' SG ' ' B' ' 379' ' ' CYS . 67.2 mtt -116.95 165.7 13.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.911 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.38 51.16 8.53 Favored 'General case' 0 CA--C 1.529 0.152 0 O-C-N 123.609 0.568 . . . . 0.0 111.324 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 383' ' ' MET . . . . . 0.418 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.87 14.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.235 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 384' ' ' VAL . . . . . 0.49 HG21 HG22 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.36 125.08 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.349 . . . . 0.0 111.369 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.69 151.72 43.01 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.412 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.1 -23.44 73.42 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.306 2.004 . . . . 0.0 112.342 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.93 -5.47 53.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.504 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.04 -36.8 5.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 389' ' ' LEU . . . . . 0.458 HD13 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.96 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.55 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 390' ' ' LEU . . . . . 0.526 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.54 -15.74 5.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.676 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -98.33 148.76 23.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.555 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -73.56 -30.26 62.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.218 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.39 -47.58 26.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.794 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.54 -44.27 91.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.795 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.43 -59.33 5.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -27.33 61.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.08 -41.09 67.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.418 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 398' ' ' ILE . . . . . 0.483 HD11 HG13 ' B' ' 384' ' ' VAL . 65.6 mt -74.86 -53.74 15.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.491 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 399' ' ' VAL . . . . . 0.529 HG22 HD12 ' B' ' 417' ' ' ILE . 59.8 t -53.28 -46.91 57.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.85 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.43 -59.99 3.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.5 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.65 -57.19 11.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.39 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.12 -32.85 15.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.333 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 403' ' ' ARG . . . . . 0.45 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.2 -57.43 4.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 111.141 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.94 -33.61 64.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.205 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 405' ' ' GLU . . . . . 0.522 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.44 -47.08 44.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.001 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 406' ' ' CYS . . . . . 0.478 ' HG ' HG21 ' B' ' 434' ' ' VAL . 3.1 m -63.78 -24.04 67.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.137 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.33 1.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.97 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.04 -17.17 12.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -106.68 -15.38 14.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.594 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.15 -139.46 4.17 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.616 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 411' ' ' LEU . . . . . 0.413 ' HB3' HG23 ' B' ' 437' ' ' THR . 1.6 mm? -114.21 132.5 56.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.645 0.259 . . . . 0.0 111.11 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.41 115.37 48.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.007 0.432 . . . . 0.0 110.631 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . 0.602 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.59 -62.0 2.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.225 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.95 -169.35 3.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.109 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 415' ' ' ILE . . . . . 0.619 HG21 HG11 ' B' ' 434' ' ' VAL . 48.7 mt -145.13 128.99 12.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.842 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 416' ' ' GLU . . . . . 0.409 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.8 108.76 18.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.712 179.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 417' ' ' ILE . . . . . 0.603 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.7 mt -128.56 108.53 18.98 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.725 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 418' ' ' PRO . . . . . 0.643 ' HD2' HG23 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.45 147.61 8.85 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.664 2.243 . . . . 0.0 112.965 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 419' ' ' ARG . . . . . 0.526 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.9 74.72 21.88 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.145 179.891 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.2 117.15 2.08 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.749 2.3 . . . . 0.0 112.434 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 421' ' ' VAL . . . . . 0.51 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 95.9 t -74.44 97.82 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.171 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.59 21.77 9.05 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.596 0.713 . . . . 0.0 109.353 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 423' ' ' GLY . . . . . 0.555 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.27 29.28 6.09 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.232 -179.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 424' ' ' VAL . . . . . 0.51 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.48 -37.49 30.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -179.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.94 35.81 4.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.787 0.327 . . . . 0.0 111.774 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 426' ' ' VAL . . . . . 0.645 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.26 -44.75 48.97 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.827 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 427' ' ' PRO . . . . . 0.645 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.2 Cg_endo -66.32 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.443 2.095 . . . . 0.0 111.078 179.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.29 -15.4 3.22 Favored Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.306 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.59 149.34 50.22 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.582 0.23 . . . . 0.0 110.829 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.49 -14.16 5.07 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.879 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 431' ' ' LYS . . . . . 0.621 ' HZ3' ' HB2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -125.42 126.2 44.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 110.979 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 432' ' ' ILE . . . . . 0.643 HG23 ' HD2' ' B' ' 418' ' ' PRO . 7.9 pt -131.06 172.94 15.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.279 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 433' ' ' PHE . . . . . 0.571 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.51 -176.42 2.81 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.968 0.413 . . . . 0.0 111.994 -178.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 434' ' ' VAL . . . . . 0.619 HG11 HG21 ' B' ' 415' ' ' ILE . 3.3 m -135.76 141.76 41.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.165 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 435' ' ' GLU . . . . . 0.473 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.7 tt0 -84.35 108.48 17.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.811 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.74 168.37 12.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.239 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 437' ' ' THR . . . . . 0.602 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.5 p -94.96 -45.32 7.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.465 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.93 146.59 52.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.077 0.465 . . . . 0.0 111.165 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.17 -12.8 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.239 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -54.91 24.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.152 0.501 . . . . 0.0 110.083 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -75.1 -29.46 60.61 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.805 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -31.86 72.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.142 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.59 -47.94 16.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.703 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.7 -11.97 59.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.723 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -56.16 3.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.898 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 446' ' ' MET . . . . . 0.418 ' SD ' ' CE2' ' B' ' 463' ' ' TYR . 2.9 ptm -61.54 -29.71 70.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.285 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.23 -16.23 63.55 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.626 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.59 -8.63 22.57 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.443 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.2 mt -95.68 -19.78 19.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.806 0.336 . . . . 0.0 110.943 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 21.8 p -70.71 130.06 40.76 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.992 175.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.49 -8.9 74.59 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.578 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -77.98 -152.2 0.05 Allowed 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 117.206 0.503 . . . . 0.0 110.531 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 453' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.11 2.29 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.858 0.361 . . . . 0.0 111.326 -179.902 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.3 -36.34 75.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.551 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.25 -50.96 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.82 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -157.2 24.94 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.753 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 457' ' ' ARG . . . . . 0.417 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.47 133.04 16.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.309 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.42 135.92 27.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 O-C-N 121.656 -0.652 . . . . 0.0 111.183 -177.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 459' ' ' VAL . . . . . 0.493 HG12 HG23 ' B' ' 461' ' ' THR . 45.1 t -91.1 121.55 41.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.167 -176.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 460' ' ' VAL . . . . . 0.463 HG22 ' CD1' ' A' ' 53' ' ' ILE . 4.7 m -94.35 98.09 7.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.507 0.67 . . . . 0.0 110.488 176.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 461' ' ' THR . . . . . 0.493 HG23 HG12 ' B' ' 459' ' ' VAL . 17.0 p -97.53 128.88 44.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.122 -177.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 462' ' ' LYS . . . . . 0.559 ' HG3' ' HB3' ' B' ' 379' ' ' CYS . 5.8 ptmt -130.14 -160.5 1.04 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.742 -178.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 463' ' ' TYR . . . . . 0.439 ' H ' ' HB2' ' B' ' 462' ' ' LYS . 1.2 m-85 -114.96 147.01 40.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.59 -175.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 464' ' ' CYS . . . . . 0.444 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.92 148.98 47.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.15 0.5 . . . . 0.0 111.33 -179.901 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 465' ' ' ASP . . . . . 0.449 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.39 129.42 66.33 Favored Pre-proline 0 CA--C 1.529 0.153 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.373 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 466' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.11 -33.23 73.19 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.704 2.269 . . . . 0.0 112.06 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.53 7.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.374 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.43 -33.77 68.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 469' ' ' TYR . . . . . 0.473 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.05 -51.21 70.61 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.221 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.31 -47.59 69.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.393 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 471' ' ' ARG . . . . . 0.459 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.65 -2.11 49.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.432 -179.915 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.01 20.86 8.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.924 0.393 . . . . 0.0 110.232 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 473' ' ' ASP . . . . . 0.459 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.88 -20.82 25.14 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.947 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 . . . . . 0 N--CA 1.471 0.601 0 CA-C-O 120.952 0.406 . . . . 0.0 111.078 -177.57 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.368 0.128 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.18 115.53 2.54 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.932 2.422 . . . . 0.0 112.32 177.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.02 -166.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.85 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.44 51.92 12.11 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.896 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.4 -36.21 3.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.927 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.72 91.85 2.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.96 -54.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.837 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.14 13.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.945 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.9 125.57 24.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.806 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.62 12.83 19.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.982 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.519 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 72.0 m95 -142.02 53.1 1.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.756 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.28 -156.64 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.794 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.476 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.25 -37.73 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.852 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.71 120.58 40.56 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.534 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.6 p . . . . . 0 C--N 1.331 -0.239 0 O-C-N 124.007 0.817 . . . . 0.0 110.869 -178.718 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.447 ' HB3' ' HG3' ' A' ' 49' ' ' GLU . 3.6 mm? . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.93 0.395 . . . . 0.0 111.479 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.414 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 7.6 p -90.76 155.93 18.44 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.35 173.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.41 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -63.01 -31.29 72.4 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 120.933 0.397 . . . . 0.0 111.388 -174.253 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.414 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.35 -45.06 61.53 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.29 -33.49 73.27 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.763 -177.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.454 ' O ' HG12 ' A' ' 53' ' ' ILE . 43.6 mt-10 -61.04 -44.54 97.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.21 177.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -62.77 -43.38 98.94 Favored 'General case' 0 C--O 1.185 -2.318 0 CA-C-O 118.884 -0.579 . . . . 0.0 110.234 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.427 ' HA ' HG21 ' A' ' 54' ' ' VAL . . . -58.41 -43.41 88.62 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 123.739 0.65 . . . . 0.0 111.535 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -65.4 -39.07 91.74 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.858 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.667 ' HA ' HD21 ' A' ' 56' ' ' LEU . 36.0 mm -78.64 -41.09 24.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.365 -178.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.43 ' O ' HG13 ' A' ' 58' ' ' ILE . 35.1 m -65.57 -35.5 75.39 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.84 0 CA-C-O 118.664 -0.684 . . . . 0.0 111.898 176.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.05 -43.04 91.65 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.509 0.595 . . . . 0.0 110.353 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.667 HD21 ' HA ' ' A' ' 53' ' ' ILE . 0.3 OUTLIER -64.93 -38.62 91.56 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.646 177.55 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.476 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 61.8 mt-30 -75.14 -30.37 60.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.421 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.46 HD13 HD11 ' A' ' 113' ' ' ILE . 72.5 mt -65.8 -47.02 87.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 122.836 0.454 . . . . 0.0 110.341 175.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.42 -41.16 85.3 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.64 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -70.33 -31.37 68.64 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.225 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.527 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.64 -44.92 76.76 Favored 'General case' 0 C--O 1.207 -1.162 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 172.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.5 -35.81 82.0 Favored 'General case' 0 N--CA 1.432 -1.346 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -178.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.485 ' O ' HG23 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.79 -42.76 76.05 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.527 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.79 -47.76 83.68 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 113.846 -1.524 . . . . 0.0 111.93 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.04 -29.0 63.73 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.867 176.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.96 -47.13 69.47 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.485 HG23 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.07 -17.69 14.41 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 119.974 -0.69 . . . . 0.0 112.815 -177.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.89 29.41 10.6 Favored Glycine 0 C--N 1.315 -0.621 0 C-N-CA 119.896 -1.145 . . . . 0.0 111.254 -177.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.4 92.95 7.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.214 0.531 . . . . 0.0 110.135 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.8 tp . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.536 177.216 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.436 -1.144 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.09 -52.53 16.36 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.218 -0.926 . . . . 0.0 109.667 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.6 mp0 -53.34 -51.74 61.46 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-N 113.614 -1.63 . . . . 0.0 110.66 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -66.61 -38.75 87.63 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 113.456 -1.702 . . . . 0.0 110.653 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.87 -44.51 94.12 Favored 'General case' 0 CA--C 1.512 -0.495 0 O-C-N 123.265 0.353 . . . . 0.0 110.356 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.71 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.8 m -69.02 -50.05 52.26 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 120.069 -0.653 . . . . 0.0 110.637 179.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.45 -41.24 93.66 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -175.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.08 -39.1 89.78 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.525 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.19 -40.16 89.07 Favored 'General case' 0 C--O 1.223 -0.308 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.71 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.93 -41.09 97.73 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.648 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.0 -34.45 78.47 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.73 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.44 -34.29 74.21 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.55 -48.79 76.05 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.607 -1.256 . . . . 0.0 107.607 175.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.549 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.24 -45.54 94.11 Favored 'General case' 0 C--O 1.213 -0.819 0 CA-C-N 114.494 -1.23 . . . . 0.0 110.436 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.28 -37.42 85.46 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.565 0.746 . . . . 0.0 110.99 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.78 -43.74 85.78 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.7 mt -72.23 -38.63 68.92 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.769 177.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.39 -50.91 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 110.51 -0.181 . . . . 0.0 110.51 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.5 m -60.7 -39.46 88.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.195 0.521 . . . . 0.0 110.535 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.598 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.52 61.24 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.004 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.43 -37.09 84.41 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.8 t -65.54 -36.86 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 176.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.72 80.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.226 0.536 . . . . 0.0 110.23 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.7 mt -71.61 -40.5 69.77 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.984 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.58 111.19 12.53 Favored Pre-proline 0 C--N 1.315 -0.896 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.013 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.68 -22.81 36.99 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.837 2.358 . . . . 0.0 112.558 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.16 0.01 55.98 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.191 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.94 134.7 54.53 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.617 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.39 109.07 62.8 Favored Pre-proline 0 CA--C 1.51 -0.589 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.32 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.23 157.93 59.67 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 122.261 1.974 . . . . 0.0 111.501 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.64 154.5 25.23 Favored 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 123.626 2.884 . . . . 0.0 111.768 177.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.08 -31.37 70.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -91.77 34.96 0.97 Allowed 'General case' 0 C--O 1.233 0.22 0 O-C-N 123.474 0.484 . . . . 0.0 111.618 -177.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 41.4 t80 . . . . . 0 C--N 1.331 -0.227 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.215 176.574 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo . . . . . 0 N--CA 1.473 0.299 0 CA-C-O 120.753 0.231 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 375' ' ' THR . . . . . 0.456 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -143.35 -71.42 0.31 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.179 -177.557 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 376' ' ' GLU . . . . . 0.473 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.9 -45.91 0.01 OUTLIER 'General case' 0 C--O 1.231 0.108 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 377' ' ' VAL . . . . . 0.431 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.95 7.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.478 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 378' ' ' LEU . . . . . 0.45 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.63 152.5 20.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.193 -178.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 379' ' ' CYS . . . . . 0.571 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.53 142.53 46.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.631 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . 0.617 HD22 HG22 ' B' ' 461' ' ' THR . 5.3 mt -132.71 102.33 5.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.377 . . . . 0.0 111.01 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 21.6 ttt -117.15 164.89 14.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.26 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.2 t30 58.15 51.12 8.97 Favored 'General case' 0 C--O 1.232 0.154 0 O-C-N 123.338 0.399 . . . . 0.0 111.278 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 383' ' ' MET . . . . . 0.787 ' HB3' HG13 ' B' ' 459' ' ' VAL . 3.0 ptm -164.86 14.37 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.258 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 384' ' ' VAL . . . . . 0.491 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.27 125.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 0.0 111.372 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . . . . . . . . . 20.1 mt -110.83 151.7 43.08 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.4 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.07 -23.52 73.62 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.353 2.035 . . . . 0.0 112.36 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.89 -5.48 53.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.494 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.77 5.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.872 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 389' ' ' LEU . . . . . 0.453 HD13 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.97 0.46 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.969 0.414 . . . . 0.0 110.615 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 390' ' ' LEU . . . . . 0.525 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.58 -15.72 5.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.652 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.36 148.76 23.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.542 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -73.57 -30.16 62.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.276 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.42 -47.66 26.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.713 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.6 -44.25 91.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.743 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.44 -59.32 5.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.221 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -27.38 61.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.27 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.08 -41.06 67.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.423 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 398' ' ' ILE . . . . . 0.476 HD11 HG11 ' B' ' 384' ' ' VAL . 65.5 mt -74.94 -53.64 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.516 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 399' ' ' VAL . . . . . 0.561 HG22 HD12 ' B' ' 417' ' ' ILE . 59.4 t -53.25 -46.98 57.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.807 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.42 -60.0 3.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.789 0.328 . . . . 0.0 111.523 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.52 -57.31 11.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.359 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.01 -32.96 15.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.326 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 403' ' ' ARG . . . . . 0.45 ' HA ' HD13 ' B' ' 415' ' ' ILE . 0.2 OUTLIER -71.18 -57.38 4.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.715 0.293 . . . . 0.0 111.149 -179.919 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.93 -33.69 64.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.15 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 405' ' ' GLU . . . . . 0.519 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.43 -47.02 45.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.96 -23.87 67.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.171 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.39 1.1 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.966 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.1 -17.17 12.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.877 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 409' ' ' TYR . . . . . 0.478 ' HH ' HD23 ' B' ' 449' ' ' LEU . 1.9 m-85 -106.61 -15.47 14.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.561 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.12 -139.41 4.15 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.536 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 411' ' ' LEU . . . . . 0.428 ' HB3' HG23 ' B' ' 437' ' ' THR . 1.6 mm? -114.29 132.46 56.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.714 0.292 . . . . 0.0 111.065 -179.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.39 115.46 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.991 0.424 . . . . 0.0 110.58 179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . 0.602 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.64 -61.93 2.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.226 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.04 -169.4 3.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.109 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 415' ' ' ILE . . . . . 0.604 HG22 HG11 ' B' ' 434' ' ' VAL . 48.8 mt -145.09 128.83 11.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 416' ' ' GLU . . . . . 0.422 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.78 108.83 18.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.732 179.781 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 417' ' ' ILE . . . . . 0.595 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.5 mt -128.53 108.47 19.04 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.708 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 418' ' ' PRO . . . . . 0.655 ' HD2' HG21 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.5 147.6 9.01 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.663 2.242 . . . . 0.0 112.904 -179.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 419' ' ' ARG . . . . . 0.525 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.84 74.75 22.06 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.143 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.27 117.11 2.07 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.79 2.327 . . . . 0.0 112.402 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 421' ' ' VAL . . . . . 0.509 ' N ' ' HB ' ' B' ' 424' ' ' VAL . 96.5 t -74.39 97.78 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.187 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.57 21.82 9.06 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.557 0.694 . . . . 0.0 109.314 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 423' ' ' GLY . . . . . 0.425 ' HA2' HG21 ' B' ' 426' ' ' VAL . . . 102.39 29.22 6.07 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.278 -179.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 424' ' ' VAL . . . . . 0.509 ' HB ' ' N ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.5 -37.6 30.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.103 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.84 35.97 4.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.804 0.335 . . . . 0.0 111.753 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 426' ' ' VAL . . . . . 0.649 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.39 -44.63 47.0 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.819 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 427' ' ' PRO . . . . . 0.649 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.33 77.07 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.473 2.115 . . . . 0.0 111.107 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.31 -15.38 3.21 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.313 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.2 t -67.52 149.39 50.23 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.511 0.196 . . . . 0.0 110.885 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.5 -14.27 5.06 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.912 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.37 126.17 44.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.845 0.355 . . . . 0.0 111.08 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 432' ' ' ILE . . . . . 0.655 HG21 ' HD2' ' B' ' 418' ' ' PRO . 7.9 pt -131.08 172.93 15.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.281 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 433' ' ' PHE . . . . . 0.571 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.37 2.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.958 0.409 . . . . 0.0 111.962 -178.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 434' ' ' VAL . . . . . 0.604 HG11 HG22 ' B' ' 415' ' ' ILE . 3.3 m -135.82 141.72 41.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.176 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 435' ' ' GLU . . . . . 0.475 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.4 108.55 17.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.821 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.78 168.37 12.52 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.249 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 437' ' ' THR . . . . . 0.602 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -94.96 -45.43 7.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.404 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.85 146.69 52.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.128 0.489 . . . . 0.0 111.183 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.22 -12.84 16.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.192 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.8 26.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.123 0.487 . . . . 0.0 110.129 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.15 -29.44 60.48 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.889 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.14 -31.81 72.34 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.186 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.69 -48.03 15.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.646 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.07 59.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.709 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.83 -54.9 3.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.961 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 446' ' ' MET . . . . . 0.42 ' O ' HG21 ' B' ' 450' ' ' THR . 4.1 ptm -64.76 -27.57 68.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.957 -179.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.58 -16.2 63.36 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.64 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.66 -8.53 22.57 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.464 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 449' ' ' LEU . . . . . 0.478 HD23 ' HH ' ' B' ' 409' ' ' TYR . 97.3 mt -95.82 -19.77 19.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.712 0.291 . . . . 0.0 110.916 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 450' ' ' THR . . . . . 0.42 HG21 ' O ' ' B' ' 446' ' ' MET . 23.1 p -69.54 131.36 44.57 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.104 175.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.63 -9.59 76.66 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.677 -0.773 . . . . 0.0 113.377 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -75.74 -152.2 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 117.2 0.5 . . . . 0.0 110.513 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 453' ' ' LYS . . . . . 0.476 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.87 117.15 2.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.948 0.404 . . . . 0.0 111.338 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.23 -36.4 75.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.542 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.21 -50.98 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.846 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.25 25.0 0.3 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.787 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 457' ' ' ARG . . . . . 0.414 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.47 136.22 19.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.325 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 458' ' ' VAL . . . . . 0.412 HG12 HE21 ' A' ' 57' ' ' GLN . 7.2 p -58.38 132.23 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 121.124 0.488 . . . . 0.0 110.949 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 459' ' ' VAL . . . . . 0.787 HG13 ' HB3' ' B' ' 383' ' ' MET . 0.9 OUTLIER -90.99 122.12 42.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.819 -174.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 460' ' ' VAL . . . . . 0.437 HG21 HG13 ' A' ' 53' ' ' ILE . 59.6 t -88.89 98.21 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.319 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 461' ' ' THR . . . . . 0.617 HG22 HD22 ' B' ' 380' ' ' LEU . 1.4 p -98.12 129.64 44.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.842 177.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 462' ' ' LYS . . . . . 0.472 ' HE3' ' HB2' ' B' ' 462' ' ' LYS . 0.5 OUTLIER -130.58 -166.35 1.67 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.268 0.556 . . . . 0.0 111.148 -179.045 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.59 146.93 37.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.525 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 464' ' ' CYS . . . . . 0.431 ' O ' HG21 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.81 148.98 47.48 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.065 0.46 . . . . 0.0 111.378 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 465' ' ' ASP . . . . . 0.456 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.46 129.35 66.42 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.398 -179.881 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 466' ' ' PRO . . . . . 0.473 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.06 -33.21 72.62 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.685 2.257 . . . . 0.0 112.103 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.07 -58.48 7.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.38 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.5 -33.67 68.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.25 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 469' ' ' TYR . . . . . 0.475 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.1 -51.18 70.7 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.183 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.37 -47.53 69.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.37 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 471' ' ' ARG . . . . . 0.457 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.73 -2.09 49.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.45 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.09 20.8 8.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.975 0.417 . . . . 0.0 110.275 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 473' ' ' ASP . . . . . 0.457 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.85 -21.48 29.49 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.954 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 . . . . . 0 N--CA 1.472 0.646 0 C-N-CA 123.121 0.568 . . . . 0.0 111.264 -177.388 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 31.3 p90 . . . . . 0 C--O 1.233 0.189 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 38.8 Cg_exo -56.52 115.56 2.57 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 123.265 2.643 . . . . 0.0 112.323 -174.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.92 12.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.94 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.36 -36.27 3.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.995 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.8 2.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.856 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.84 -54.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.812 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.9 111.13 13.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.94 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.92 125.59 24.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.697 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.62 12.88 19.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.992 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.518 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.8 m95 -142.06 53.02 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.706 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.29 -156.54 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.84 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.465 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.33 -37.63 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.867 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.75 121.29 42.86 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.557 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 p . . . . . 0 C--N 1.327 -0.388 0 O-C-N 123.625 0.578 . . . . 0.0 111.067 179.207 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 44' ' ' LEU . 3.4 mm? . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.927 0.394 . . . . 0.0 111.521 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.449 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 1.4 p -84.93 154.27 22.31 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.605 175.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.415 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.06 -31.3 71.71 Favored 'General case' 0 C--O 1.24 0.597 0 O-C-N 123.368 0.418 . . . . 0.0 111.395 -175.029 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.449 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.3 -45.23 60.91 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.18 -32.69 72.17 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.753 -177.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.439 ' O ' HG12 ' A' ' 53' ' ' ILE . 36.1 mt-10 -61.16 -44.78 96.78 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.243 178.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.437 ' O ' HG21 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.37 -43.32 97.94 Favored 'General case' 0 C--O 1.186 -2.252 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.235 177.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.456 ' HA ' HG21 ' A' ' 54' ' ' VAL . . . -58.43 -42.13 86.61 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 123.719 0.637 . . . . 0.0 111.585 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -66.29 -38.86 88.76 Favored 'General case' 0 N--CA 1.462 0.165 0 O-C-N 123.824 0.703 . . . . 0.0 110.933 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.584 ' HA ' HD21 ' A' ' 56' ' ' LEU . 29.6 mm -78.31 -41.52 26.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.197 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.456 HG21 ' HA ' ' A' ' 51' ' ' ALA . 35.0 m -66.41 -35.44 74.92 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.809 0 CA-C-O 118.586 -0.721 . . . . 0.0 111.958 177.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.15 -45.43 90.99 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 118.541 0.61 . . . . 0.0 110.308 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.584 HD21 ' HA ' ' A' ' 53' ' ' ILE . 0.1 OUTLIER -70.55 -23.71 62.67 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.077 -178.321 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -89.53 -26.67 20.75 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.669 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.462 HD12 HD11 ' A' ' 113' ' ' ILE . 72.7 mt -64.04 -46.94 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.175 0.59 . . . . 0.0 110.395 170.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.405 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.45 -41.15 85.17 Favored 'General case' 0 CA--C 1.513 -0.474 0 C-N-CA 120.294 -0.563 . . . . 0.0 110.685 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -36.5 83.11 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.844 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -66.61 -44.95 80.71 Favored 'General case' 0 C--O 1.206 -1.187 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.51 -35.81 81.98 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.468 ' O ' HG21 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.82 -42.76 76.19 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 122.095 0.95 . . . . 0.0 108.53 176.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.519 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.76 -47.73 83.88 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 113.827 -1.533 . . . . 0.0 111.897 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.23 -28.79 63.39 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 119.741 -0.784 . . . . 0.0 111.831 176.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -68.1 -47.07 69.19 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.468 HG21 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.48 14.46 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 119.965 -0.694 . . . . 0.0 112.86 -177.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.77 29.41 10.74 Favored Glycine 0 C--N 1.316 -0.565 0 C-N-CA 119.804 -1.188 . . . . 0.0 111.28 -177.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.4 91.08 6.77 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.253 0.549 . . . . 0.0 110.215 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.454 178.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.435 -1.206 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.11 -52.5 16.46 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.261 -0.9 . . . . 0.0 109.706 -178.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.3 mp0 -53.34 -51.7 61.58 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-N 113.663 -1.608 . . . . 0.0 110.656 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.64 -38.75 87.55 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.435 -1.712 . . . . 0.0 110.704 -177.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.513 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.83 -44.59 93.98 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 123.237 0.336 . . . . 0.0 110.371 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.705 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.7 m -69.05 -50.0 52.49 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.613 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.46 -41.27 93.55 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -175.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.0 -39.17 90.05 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 110.351 -0.241 . . . . 0.0 110.351 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.23 -40.13 89.12 Favored 'General case' 0 C--O 1.223 -0.308 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.705 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.93 -41.06 97.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.135 -0.938 . . . . 0.0 110.663 178.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.01 -34.36 78.26 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.811 178.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.52 -34.29 74.05 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 177.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.45 -48.86 75.99 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 175.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.547 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.2 ttp180 -61.26 -45.51 94.21 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.441 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.21 -37.47 85.47 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 123.567 0.747 . . . . 0.0 111.016 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.79 -43.73 85.8 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.8 mt -72.3 -38.49 68.73 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.814 177.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.4 -50.98 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 110.472 -0.195 . . . . 0.0 110.472 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.9 m -60.6 -39.6 88.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.219 0.533 . . . . 0.0 110.514 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.593 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.89 -49.64 60.83 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.952 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.1 84.46 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.3 t -65.52 -36.87 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 176.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.7 79.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.197 0.523 . . . . 0.0 110.22 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.3 mt -71.46 -40.56 70.23 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.045 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.63 111.22 12.48 Favored Pre-proline 0 C--N 1.316 -0.853 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.76 -22.63 36.8 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.861 2.374 . . . . 0.0 112.588 -178.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.34 0.07 55.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.405 0.621 . . . . 0.0 111.178 -177.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.84 134.61 54.43 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.61 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.35 109.16 62.89 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.323 177.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.27 157.92 59.76 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.271 1.981 . . . . 0.0 111.501 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.56 154.5 24.82 Favored 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 123.648 2.899 . . . . 0.0 111.813 177.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.1 -31.49 71.13 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -90.08 20.73 4.1 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 123.771 0.669 . . . . 0.0 111.733 -176.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 23.2 t80 . . . . . 0 C--N 1.331 -0.224 0 CA-C-O 120.815 0.34 . . . . 0.0 110.151 175.583 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 CA--C 1.529 0.262 0 CA-C-O 121.114 0.381 . . . . 0.0 112.973 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 375' ' ' THR . . . . . 0.441 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -120.84 -71.3 0.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.166 178.638 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 376' ' ' GLU . . . . . 0.48 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.96 0.01 OUTLIER 'General case' 0 C--O 1.231 0.097 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 377' ' ' VAL . . . . . 0.447 HG23 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.95 7.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.471 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 378' ' ' LEU . . . . . 0.448 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.55 152.54 20.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.271 -179.072 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 379' ' ' CYS . . . . . 0.578 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.57 142.53 46.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.59 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . 0.411 HD13 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.73 101.82 5.43 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.925 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 20.3 ttt -116.83 164.7 14.27 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.59 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.1 t30 58.58 51.19 8.14 Favored 'General case' 0 C--N 1.342 0.278 0 O-C-N 123.479 0.487 . . . . 0.0 111.316 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 383' ' ' MET . . . . . 0.409 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.85 14.4 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.253 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 384' ' ' VAL . . . . . 0.479 HG11 HD11 ' B' ' 398' ' ' ILE . 0.5 OUTLIER -152.31 125.17 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.845 0.355 . . . . 0.0 111.311 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.4 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.0 mt -110.78 151.78 43.1 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.34 179.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.25 -23.35 72.5 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.273 1.982 . . . . 0.0 112.343 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.94 -5.52 53.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.484 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.02 -36.76 5.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.904 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 389' ' ' LEU . . . . . 0.437 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.96 34.92 0.46 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.913 0.387 . . . . 0.0 110.636 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 390' ' ' LEU . . . . . 0.522 HD22 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.55 -15.66 5.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.659 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.31 148.71 23.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.573 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -73.5 -30.25 63.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.225 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.35 -47.68 26.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.754 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.51 -44.26 91.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.852 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.41 -59.45 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.162 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -27.29 61.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.275 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.23 -40.94 67.39 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.429 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 398' ' ' ILE . . . . . 0.479 HD11 HG11 ' B' ' 384' ' ' VAL . 65.5 mt -74.93 -53.65 16.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.525 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 399' ' ' VAL . . . . . 0.584 HG23 HD12 ' B' ' 417' ' ' ILE . 59.7 t -53.3 -46.86 57.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.846 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.47 -60.0 3.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.74 0.305 . . . . 0.0 111.526 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.69 -57.14 11.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.341 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.7 t -52.04 -32.99 15.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.387 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 403' ' ' ARG . . . . . 0.45 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.15 -57.39 4.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 111.173 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.9 -33.62 64.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.214 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 405' ' ' GLU . . . . . 0.518 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 22.0 mm-40 -73.48 -47.06 44.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.963 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.81 -23.97 67.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.131 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.08 30.25 1.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.895 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.01 -17.18 12.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.42 14.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.551 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.14 -139.46 4.17 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.553 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 411' ' ' LEU . . . . . 0.416 ' HB3' HG22 ' B' ' 437' ' ' THR . 1.6 mm? -114.21 132.51 56.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.09 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.38 115.45 48.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.028 0.442 . . . . 0.0 110.658 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . 0.602 ' HG3' HG21 ' B' ' 437' ' ' THR . 10.9 mttt -56.69 -61.97 2.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.179 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.96 -169.33 3.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.188 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 415' ' ' ILE . . . . . 0.568 HG22 HG11 ' B' ' 434' ' ' VAL . 48.6 mt -145.2 128.94 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.825 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 416' ' ' GLU . . . . . 0.414 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.93 108.76 18.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.692 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 417' ' ' ILE . . . . . 0.599 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.1 mt -128.42 108.48 19.24 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.688 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 418' ' ' PRO . . . . . 0.649 ' HD2' HG21 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.48 147.61 8.95 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.673 2.248 . . . . 0.0 112.913 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 419' ' ' ARG . . . . . 0.522 HH21 HD22 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.86 74.61 22.1 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.155 179.899 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.1 117.0 1.96 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.782 2.321 . . . . 0.0 112.46 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 421' ' ' VAL . . . . . 0.516 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.2 t -74.34 97.84 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.199 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.5 21.84 8.99 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.61 0.719 . . . . 0.0 109.386 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 423' ' ' GLY . . . . . 0.555 ' HA2' HG21 ' B' ' 426' ' ' VAL . . . 102.31 29.21 6.1 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.273 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 424' ' ' VAL . . . . . 0.516 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.42 -37.57 31.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.86 35.92 4.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.331 . . . . 0.0 111.825 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 426' ' ' VAL . . . . . 0.652 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.41 -44.59 46.65 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.827 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 427' ' ' PRO . . . . . 0.652 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.8 Cg_endo -66.3 77.07 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.516 2.144 . . . . 0.0 111.113 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.34 -15.47 3.2 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.338 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.53 149.37 50.25 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.591 0.234 . . . . 0.0 110.793 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.54 -14.24 5.05 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.856 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 126.16 44.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.833 0.349 . . . . 0.0 111.028 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 432' ' ' ILE . . . . . 0.649 HG21 ' HD2' ' B' ' 418' ' ' PRO . 7.8 pt -131.03 172.89 15.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.243 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 433' ' ' PHE . . . . . 0.578 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.3 2.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.989 0.423 . . . . 0.0 111.974 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 434' ' ' VAL . . . . . 0.568 HG11 HG22 ' B' ' 415' ' ' ILE . 3.3 m -135.88 141.71 41.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.207 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 435' ' ' GLU . . . . . 0.475 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.3 108.49 17.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.819 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.79 168.36 12.53 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.227 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 437' ' ' THR . . . . . 0.602 HG21 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.93 -45.39 7.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.438 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.91 146.66 52.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.096 0.474 . . . . 0.0 111.215 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.25 -12.7 16.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.263 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.87 25.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.082 0.468 . . . . 0.0 110.088 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.16 -29.37 60.43 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.864 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 442' ' ' CYS . . . . . 0.547 ' HB3' ' HH ' ' B' ' 463' ' ' TYR . 0.3 OUTLIER -62.32 -31.68 72.32 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.168 179.241 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.64 -48.06 15.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.649 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.08 59.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.719 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -55.6 3.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.993 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 446' ' ' MET . . . . . . . . . . . . . 3.4 ptm -64.14 -26.98 68.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.178 -179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.16 -16.25 63.06 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.625 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.51 22.7 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.415 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 449' ' ' LEU . . . . . 0.632 ' HB2' HG21 ' B' ' 461' ' ' THR . 97.2 mt -95.72 -20.55 18.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.797 0.332 . . . . 0.0 110.894 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 3.3 t -72.59 131.72 42.83 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.899 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.98 -9.81 72.53 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.157 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -77.11 -152.22 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 117.239 0.52 . . . . 0.0 110.587 178.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 453' ' ' LYS . . . . . 0.465 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.83 117.08 2.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.853 0.358 . . . . 0.0 111.285 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.23 -36.43 75.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.524 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.16 -50.92 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.814 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.23 24.86 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.761 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 457' ' ' ARG . . . . . 0.409 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.38 134.77 18.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.344 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 2.8 m -59.65 138.42 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-O 121.042 0.449 . . . . 0.0 111.62 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 57.5 t -98.73 115.79 40.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.419 -176.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 460' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -82.81 114.5 23.75 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.796 174.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 461' ' ' THR . . . . . 0.632 HG21 ' HB2' ' B' ' 449' ' ' LEU . 14.1 p -100.96 132.14 46.51 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.139 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 462' ' ' LYS . . . . . 0.416 ' HE3' ' HB2' ' B' ' 462' ' ' LYS . 0.0 OUTLIER -127.46 -175.74 3.54 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.727 0.775 . . . . 0.0 111.455 -177.045 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 463' ' ' TYR . . . . . 0.547 ' HH ' ' HB3' ' B' ' 442' ' ' CYS . 1.2 m-85 -111.54 146.9 36.5 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.473 172.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 464' ' ' CYS . . . . . 0.447 ' O ' HG23 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 149.03 47.47 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.992 0.425 . . . . 0.0 111.431 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 465' ' ' ASP . . . . . 0.441 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.46 129.36 66.37 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.374 -179.812 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 466' ' ' PRO . . . . . 0.48 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -53.98 -33.31 72.16 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.76 2.307 . . . . 0.0 112.127 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -58.49 7.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.399 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.44 -33.72 68.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.278 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 469' ' ' TYR . . . . . 0.475 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.03 -51.23 70.54 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.203 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.36 -47.6 69.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.291 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 471' ' ' ARG . . . . . 0.462 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.67 -2.19 49.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.383 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.78 8.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 0.0 110.234 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 473' ' ' ASP . . . . . 0.462 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.66 -20.45 21.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.951 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 11.5 p90 . . . . . 0 N--CA 1.477 0.884 0 C-N-CA 124.82 1.248 . . . . 0.0 112.771 -177.428 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 . . . . . 0 C--O 1.233 0.192 0 CA-C-O 120.455 0.169 . . . . 0.0 110.948 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.28 115.57 2.57 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.936 2.424 . . . . 0.0 112.25 172.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.02 -166.75 1.32 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.859 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.91 12.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.878 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.3 -36.29 3.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.043 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.76 91.89 2.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.855 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.9 -54.33 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.786 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.82 111.24 13.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.01 125.63 25.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.787 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.59 12.78 19.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.976 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.519 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.4 m95 -141.97 53.08 1.48 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.791 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -156.58 0.13 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.854 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.47 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.33 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.927 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.73 120.36 39.81 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.609 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.9 m . . . . . 0 C--N 1.331 -0.211 0 O-C-N 123.655 0.597 . . . . 0.0 110.782 -177.578 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.22 0 CA-C-O 120.942 0.401 . . . . 0.0 111.665 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.517 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 23.3 p -106.08 163.43 12.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.178 178.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.406 ' HD3' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -60.98 -31.39 70.98 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.337 -176.504 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.517 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.32 -45.17 61.13 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.11 -33.44 73.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.762 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.499 ' HB2' HD22 ' A' ' 44' ' ' LEU . 41.6 tt0 -58.89 -46.49 87.73 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.344 177.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.466 ' O ' HG22 ' A' ' 54' ' ' VAL . 16.0 mmt180 -63.21 -43.36 98.34 Favored 'General case' 0 C--O 1.185 -2.304 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.267 177.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.461 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.45 -42.15 86.74 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 123.739 0.649 . . . . 0.0 111.58 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -64.31 -44.98 89.91 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.162 176.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.43 HD13 ' HA ' ' A' ' 53' ' ' ILE . 8.6 mm -71.5 -41.73 72.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.319 -179.273 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -67.21 -35.64 74.66 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.768 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.835 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.01 -43.32 91.52 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 118.558 0.617 . . . . 0.0 110.277 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.581 ' HG ' ' N ' ' A' ' 57' ' ' GLN . 0.1 OUTLIER -63.23 -41.91 99.16 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.776 176.817 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.581 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 52.0 mt-30 -72.51 -31.27 65.2 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.742 178.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 54' ' ' VAL . 73.3 mt -64.51 -47.0 91.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 123.147 0.279 . . . . 0.0 110.447 176.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.46 -41.39 84.76 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.231 -0.588 . . . . 0.0 110.701 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.465 ' OD2' HD11 ' A' ' 56' ' ' LEU . 69.3 m-20 -69.1 -33.61 73.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.176 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.532 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -65.92 -45.0 83.52 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 173.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 m -65.51 -35.73 81.73 Favored 'General case' 0 N--CA 1.433 -1.321 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.443 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.84 -42.75 76.23 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 122.055 0.931 . . . . 0.0 108.505 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.532 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.85 -47.72 83.75 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 113.837 -1.528 . . . . 0.0 111.871 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.23 -28.84 63.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.818 177.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -67.95 -47.17 69.39 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.443 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.48 14.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.916 -0.714 . . . . 0.0 112.858 -177.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.78 29.41 10.73 Favored Glycine 0 C--N 1.316 -0.575 0 C-N-CA 119.809 -1.186 . . . . 0.0 111.267 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.43 92.11 6.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.227 0.537 . . . . 0.0 110.138 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.2 tp . . . . . 0 N--CA 1.463 0.201 0 CA-C-O 120.817 0.341 . . . . 0.0 111.024 179.954 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.435 -1.179 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.23 -52.44 16.41 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.191 -0.943 . . . . 0.0 109.603 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -53.33 -51.75 61.37 Favored 'General case' 0 CA--C 1.503 -0.836 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.629 -178.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.62 -38.71 87.5 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 113.417 -1.719 . . . . 0.0 110.686 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.508 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.99 -44.45 94.5 Favored 'General case' 0 CA--C 1.511 -0.528 0 O-C-N 123.209 0.318 . . . . 0.0 110.363 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.702 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.4 m -68.99 -50.08 52.11 Favored 'General case' 0 N--CA 1.428 -1.54 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.629 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.429 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.44 -41.32 93.61 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -175.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.02 -39.1 89.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.547 0.213 . . . . 0.0 110.432 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.22 -40.15 89.13 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.7 mt -63.99 -41.02 97.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.641 178.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.429 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.06 -34.39 78.3 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.798 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.4 -34.36 74.37 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 177.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.46 -48.76 76.36 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 175.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.53 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.37 -45.41 94.49 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.405 179.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.28 -37.47 85.65 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.939 -178.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.76 -43.81 85.7 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.5 mt -72.17 -38.58 69.1 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.749 177.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.0 mm -57.49 -50.79 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 110.507 -0.182 . . . . 0.0 110.507 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.9 m -60.84 -39.37 88.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.212 0.529 . . . . 0.0 110.523 -179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.597 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -68.0 -49.59 60.66 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.02 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.3 -37.21 84.88 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.5 t -65.41 -36.9 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-O 121.171 0.51 . . . . 0.0 109.657 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.69 -40.69 79.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.2 0.524 . . . . 0.0 110.238 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.0 mt -71.41 -40.56 70.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.118 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.66 111.14 12.43 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.957 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.73 -22.64 36.97 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.78 2.32 . . . . 0.0 112.545 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.38 0.23 55.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.337 0.589 . . . . 0.0 111.151 -177.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -65.02 134.63 54.29 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.623 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.34 109.17 62.91 Favored Pre-proline 0 CA--C 1.509 -0.622 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.276 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -68.31 157.97 59.53 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.317 2.011 . . . . 0.0 111.456 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.69 154.44 25.73 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 123.634 2.889 . . . . 0.0 111.711 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.95 -30.41 69.7 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -173.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -85.54 3.49 40.31 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 123.716 0.635 . . . . 0.0 111.481 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 33.2 t80 . . . . . 0 C--N 1.333 -0.128 0 CA-C-O 120.875 0.369 . . . . 0.0 110.644 178.686 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.635 0.181 . . . . 0.0 111.699 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 375' ' ' THR . . . . . 0.447 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -126.29 -71.35 0.69 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.165 -174.72 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 376' ' ' GLU . . . . . 0.482 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.9 0.01 OUTLIER 'General case' 0 C--O 1.231 0.095 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 377' ' ' VAL . . . . . 0.452 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.7 150.89 8.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.458 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 378' ' ' LEU . . . . . 0.534 HD23 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.57 152.53 20.86 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.276 -179.078 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 379' ' ' CYS . . . . . 0.576 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.49 142.53 46.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.684 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . 0.429 HD11 HG12 ' B' ' 434' ' ' VAL . 5.3 mt -132.71 101.84 5.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.953 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 2.6 tmm? -117.86 166.49 12.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.45 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 382' ' ' ASN . . . . . 0.439 HD22 ' NE2' ' A' ' 57' ' ' GLN . 13.2 t30 57.8 51.18 9.52 Favored 'General case' 0 CA--C 1.528 0.105 0 O-C-N 123.599 0.562 . . . . 0.0 111.415 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 383' ' ' MET . . . . . 0.803 ' HB3' HG11 ' B' ' 459' ' ' VAL . 3.0 ptm -164.85 14.33 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.236 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 384' ' ' VAL . . . . . 0.464 HG12 HD13 ' B' ' 398' ' ' ILE . 0.4 OUTLIER -152.27 125.17 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.86 0.362 . . . . 0.0 111.308 179.876 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . . . . . . . . . 20.1 mt -110.72 151.76 43.05 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.396 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.16 -23.47 73.05 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.286 1.991 . . . . 0.0 112.294 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.91 -5.52 53.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.45 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.69 5.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.928 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 389' ' ' LEU . . . . . 0.458 HD12 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.595 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 390' ' ' LEU . . . . . 0.523 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.62 -15.69 5.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.605 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.3 148.83 23.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.606 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -73.64 -30.23 62.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.16 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.33 -47.61 26.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.997 0.427 . . . . 0.0 110.833 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.59 -44.23 91.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.841 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.37 -59.43 4.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.181 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -27.25 61.5 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.196 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.2 -41.05 67.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.401 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 398' ' ' ILE . . . . . 0.464 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.83 -53.65 16.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.542 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 399' ' ' VAL . . . . . 0.558 HG23 HD13 ' B' ' 417' ' ' ILE . 59.7 t -53.32 -46.91 58.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.817 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.5 -59.94 3.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.526 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.67 -57.14 11.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.369 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.13 -32.88 15.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.303 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 403' ' ' ARG . . . . . 0.454 ' HA ' HD13 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.19 -57.36 4.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.751 0.31 . . . . 0.0 111.166 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.92 -33.66 64.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.171 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 405' ' ' GLU . . . . . 0.519 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.43 -47.1 44.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.83 -23.96 67.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.13 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.14 30.28 1.12 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.932 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.08 -17.06 12.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.74 -15.45 14.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.558 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.19 -139.45 4.15 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.573 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.24 132.46 56.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.697 0.284 . . . . 0.0 111.113 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.39 115.48 48.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.012 0.434 . . . . 0.0 110.543 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . 0.611 ' HG3' HG23 ' B' ' 437' ' ' THR . 10.9 mttt -56.6 -61.96 2.06 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.248 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.04 -169.43 3.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.103 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 415' ' ' ILE . . . . . 0.59 HG23 HG13 ' B' ' 434' ' ' VAL . 48.3 mt -145.05 128.96 12.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.849 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 416' ' ' GLU . . . . . 0.408 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.91 108.84 18.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.702 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 417' ' ' ILE . . . . . 0.603 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.7 mt -128.52 108.62 19.07 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.637 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 418' ' ' PRO . . . . . 0.633 ' HD2' HG23 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.49 147.56 9.0 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.709 2.273 . . . . 0.0 112.87 -179.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 419' ' ' ARG . . . . . 0.523 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.89 74.64 21.97 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.194 179.875 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -47.14 117.04 1.99 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.739 2.293 . . . . 0.0 112.504 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 421' ' ' VAL . . . . . 0.512 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.7 t -74.28 97.8 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.22 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.57 21.74 8.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.482 0.658 . . . . 0.0 109.348 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 423' ' ' GLY . . . . . 0.554 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.4 29.21 6.07 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.263 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 424' ' ' VAL . . . . . 0.512 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.45 -37.59 30.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.119 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.83 35.9 4.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.844 0.355 . . . . 0.0 111.849 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 426' ' ' VAL . . . . . 0.65 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.22 -44.75 49.35 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.839 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 427' ' ' PRO . . . . . 0.65 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.1 Cg_endo -66.33 77.16 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.537 2.158 . . . . 0.0 111.018 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.21 -15.43 3.23 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.367 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.5 149.37 50.26 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.615 0.245 . . . . 0.0 110.79 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.15 5.06 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.838 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.52 126.1 44.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.899 0.38 . . . . 0.0 111.0 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 432' ' ' ILE . . . . . 0.633 HG23 ' HD2' ' B' ' 418' ' ' PRO . 7.9 pt -130.98 172.92 15.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.256 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 433' ' ' PHE . . . . . 0.576 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.34 2.79 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.954 -178.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 434' ' ' VAL . . . . . 0.59 HG13 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.85 141.73 41.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.188 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 435' ' ' GLU . . . . . 0.476 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.41 108.53 17.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.752 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.83 168.39 12.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.256 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 437' ' ' THR . . . . . 0.611 HG23 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -94.97 -45.4 7.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.451 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.87 146.67 52.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.07 0.462 . . . . 0.0 111.26 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.21 -12.77 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.165 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.62 -54.8 26.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.09 0.471 . . . . 0.0 110.096 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.14 -29.52 60.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.818 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 442' ' ' CYS . . . . . 0.565 ' HB3' ' HH ' ' B' ' 463' ' ' TYR . 0.3 OUTLIER -62.22 -31.68 72.26 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.22 179.246 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.66 -48.0 15.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.682 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.62 -12.03 59.52 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.738 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -55.28 3.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.949 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 446' ' ' MET . . . . . 0.534 ' HB3' HD23 ' B' ' 378' ' ' LEU . 0.2 OUTLIER -64.83 -26.6 68.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.199 -179.313 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.16 -16.2 63.06 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.588 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.62 -8.63 22.52 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.354 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.3 mt -95.69 -20.76 18.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.726 0.298 . . . . 0.0 110.898 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 15.8 p -73.95 126.73 31.1 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.063 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 98.35 -9.06 62.77 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.978 178.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -76.59 -152.21 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.787 0.293 . . . . 0.0 110.505 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 453' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.1 2.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.768 0.318 . . . . 0.0 111.296 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.35 -36.29 75.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.515 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.26 -50.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.3 24.86 0.3 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.779 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 457' ' ' ARG . . . . . 0.415 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.52 135.74 19.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.316 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 13.4 p -59.41 126.94 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 121.273 0.559 . . . . 0.0 111.034 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 459' ' ' VAL . . . . . 0.803 HG11 ' HB3' ' B' ' 383' ' ' MET . 3.7 m -84.86 127.82 39.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.844 -176.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 460' ' ' VAL . . . . . . . . . . . . . 47.0 t -95.45 92.55 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.063 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 67.5 p -100.25 128.01 46.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.907 0.384 . . . . 0.0 111.316 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 462' ' ' LYS . . . . . 0.402 ' HE3' ' HB2' ' B' ' 462' ' ' LYS . 11.7 mtmt -132.02 -159.67 0.98 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.038 -178.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 463' ' ' TYR . . . . . 0.565 ' HH ' ' HB3' ' B' ' 442' ' ' CYS . 1.2 m-85 -113.32 147.02 38.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.53 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 464' ' ' CYS . . . . . 0.452 ' O ' HG21 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.88 149.0 47.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.049 0.452 . . . . 0.0 111.311 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 465' ' ' ASP . . . . . 0.447 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.33 129.34 66.86 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.405 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 466' ' ' PRO . . . . . 0.482 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.09 -33.21 72.88 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.708 2.272 . . . . 0.0 112.095 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.06 -58.55 7.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.37 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.33 -33.81 68.11 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.291 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 469' ' ' TYR . . . . . 0.476 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.5 t80 -60.12 -51.18 70.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.162 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.42 -47.5 69.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.326 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 471' ' ' ARG . . . . . 0.463 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.17 49.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.39 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.11 20.8 8.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.888 0.375 . . . . 0.0 110.215 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 473' ' ' ASP . . . . . 0.463 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.72 -20.94 24.56 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.978 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 16.6 t80 . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 121.23 0.538 . . . . 0.0 110.541 178.289 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.1 p90 . . . . . 0 CA--C 1.531 0.235 0 N-CA-C 110.545 -0.169 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.77 115.49 2.52 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.664 2.243 . . . . 0.0 112.384 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.98 -166.76 1.33 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.904 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.34 51.97 12.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.41 -36.15 3.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.002 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.79 91.85 2.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.863 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.93 -54.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.799 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.87 111.13 13.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.005 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.93 125.69 25.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.735 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.67 12.73 19.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.961 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.589 ' HZ3' HG13 ' B' ' 459' ' ' VAL . 71.6 m95 -141.97 52.97 1.48 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.766 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.15 -156.59 0.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.928 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.464 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.3 -37.65 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.76 121.26 42.76 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 118.951 -0.547 . . . . 0.0 110.64 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.3 p . . . . . 0 C--N 1.325 -0.461 0 O-C-N 123.266 0.353 . . . . 0.0 110.904 -179.622 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.409 ' HG ' ' N ' ' A' ' 45' ' ' THR . 1.5 pt? . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 120.72 0.295 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.593 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 40.3 p -119.35 170.04 9.47 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.493 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.402 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.0 -31.32 71.68 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.297 178.74 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.593 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.32 -44.99 61.89 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.441 ' H ' ' HG1' ' A' ' 45' ' ' THR . 5.2 tp-100 -69.43 -33.27 72.72 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.631 -176.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -57.8 -48.23 80.3 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.095 176.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.439 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.62 -43.41 98.88 Favored 'General case' 0 C--O 1.186 -2.285 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.236 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.451 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.44 -40.08 81.57 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.782 0.676 . . . . 0.0 111.557 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -67.57 -45.79 74.55 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.021 175.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.599 HG23 HG23 ' B' ' 460' ' ' VAL . 95.8 mt -61.68 -49.14 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 177.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' A' ' 51' ' ' ALA . 34.9 m -67.51 -35.54 73.55 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.776 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.916 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.15 -44.58 92.09 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.568 0.622 . . . . 0.0 110.319 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.5 tp -65.29 -35.36 80.77 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.976 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -75.12 -34.6 61.71 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.656 176.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.473 HD12 HD13 ' A' ' 113' ' ' ILE . 72.8 mt -63.05 -46.91 94.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.401 0.68 . . . . 0.0 110.433 177.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.41 -41.39 84.94 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.668 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -67.68 -34.01 76.06 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.404 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.523 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.48 -45.02 77.12 Favored 'General case' 0 C--O 1.207 -1.181 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 174.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.1 m -65.43 -35.86 82.2 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.446 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.8 -42.73 76.04 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.054 0.931 . . . . 0.0 108.529 176.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.523 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.84 -47.77 83.59 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 113.833 -1.53 . . . . 0.0 111.871 179.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.17 -28.92 63.54 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.758 177.093 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.91 -47.16 69.53 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.09 -17.52 14.46 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.75 29.47 10.68 Favored Glycine 0 C--N 1.315 -0.605 0 C-N-CA 119.858 -1.163 . . . . 0.0 111.259 -177.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.4 92.07 6.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.185 0.517 . . . . 0.0 110.165 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 18.3 tp . . . . . 0 C--N 1.325 -0.464 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.503 179.141 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.2 t . . . . . 0 N--CA 1.436 -1.138 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.19 -52.43 16.55 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.329 -0.857 . . . . 0.0 109.693 -178.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.5 mp0 -53.27 -51.83 60.98 Favored 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 113.655 -1.611 . . . . 0.0 110.633 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -66.67 -38.64 87.24 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.686 -177.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.511 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.96 -44.46 94.42 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 123.197 0.311 . . . . 0.0 110.385 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.695 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.9 m -69.06 -50.04 51.98 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.617 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.4 -41.28 93.82 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.95 -39.23 90.27 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 178.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.521 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.27 -40.06 89.04 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.4 mt -64.07 -40.94 97.37 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.648 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.12 -34.3 78.08 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.75 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.5 -34.39 74.23 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.4 -48.81 76.29 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.549 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.3 -45.55 94.01 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.39 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.14 -37.47 85.31 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 123.594 0.758 . . . . 0.0 111.004 -178.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.85 -43.76 86.13 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.4 mt -72.23 -38.57 68.92 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.773 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.38 -50.9 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 N-CA-C 110.514 -0.18 . . . . 0.0 110.514 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.7 m -60.71 -39.46 88.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.276 0.56 . . . . 0.0 110.551 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -68.0 -49.51 61.16 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.97 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.11 84.49 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -177.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.63 -36.85 78.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.53 -40.72 80.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.257 0.551 . . . . 0.0 110.299 177.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.5 mt -71.52 -40.6 70.0 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.982 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.64 111.23 12.47 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 116.3 -0.409 . . . . 0.0 109.929 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.78 -22.61 36.66 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.779 2.319 . . . . 0.0 112.62 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.29 0.06 55.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.409 0.623 . . . . 0.0 111.179 -177.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.91 134.64 54.42 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.606 -178.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.39 109.13 62.86 Favored Pre-proline 0 CA--C 1.509 -0.619 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.278 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.31 157.95 59.65 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.306 2.004 . . . . 0.0 111.507 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.67 154.52 25.35 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 123.589 2.859 . . . . 0.0 111.724 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.11 70.57 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -173.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -86.15 32.89 0.61 Allowed 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.765 0.666 . . . . 0.0 111.626 -177.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 9.3 p90 . . . . . 0 C--O 1.233 0.191 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.591 177.89 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 C--O 1.233 0.254 0 CA-C-O 120.964 0.319 . . . . 0.0 112.696 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 375' ' ' THR . . . . . 0.45 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -129.5 -71.32 0.62 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.217 179.161 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 376' ' ' GLU . . . . . 0.481 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.93 0.01 OUTLIER 'General case' 0 C--O 1.232 0.133 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 377' ' ' VAL . . . . . 0.451 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.62 150.99 7.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.402 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 378' ' ' LEU . . . . . 0.501 HD13 ' HG ' ' B' ' 442' ' ' CYS . 0.2 OUTLIER -90.67 152.51 20.82 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.17 -179.085 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 379' ' ' CYS . . . . . 0.554 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.53 142.53 46.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.662 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . 0.42 ' HB3' ' SD ' ' B' ' 383' ' ' MET . 5.4 mt -132.71 101.9 5.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.96 -179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 91.4 mtp -117.36 166.89 11.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.849 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 57.46 51.2 10.08 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 123.649 0.593 . . . . 0.0 111.273 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 383' ' ' MET . . . . . 0.42 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.83 14.4 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.228 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 384' ' ' VAL . . . . . 0.485 HG11 HD13 ' B' ' 398' ' ' ILE . 0.5 OUTLIER -152.25 125.06 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.721 0.296 . . . . 0.0 111.394 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . . . . . . . . . 20.1 mt -110.72 151.77 43.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.431 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.23 -23.43 72.57 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.351 2.034 . . . . 0.0 112.237 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.95 -5.51 53.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.477 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.73 5.78 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.888 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 389' ' ' LEU . . . . . 0.446 HD13 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.87 34.86 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.932 0.396 . . . . 0.0 110.607 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 390' ' ' LEU . . . . . 0.516 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.51 -15.76 5.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.674 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.29 148.74 23.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.551 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -73.58 -30.27 62.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.168 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 32.8 mm-40 -75.25 -47.76 26.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.998 0.428 . . . . 0.0 110.743 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.54 -44.25 91.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.826 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.37 -59.37 5.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.214 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.29 61.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.203 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.14 -41.02 67.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.402 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 398' ' ' ILE . . . . . 0.485 HD13 HG11 ' B' ' 384' ' ' VAL . 65.4 mt -74.94 -53.69 15.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.474 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 399' ' ' VAL . . . . . 0.564 HG23 HD12 ' B' ' 417' ' ' ILE . 59.5 t -53.22 -46.98 57.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.801 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.92 3.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.517 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.73 -57.16 11.84 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.331 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.1 -32.84 15.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.385 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 403' ' ' ARG . . . . . 0.441 ' HA ' HD12 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.27 -57.39 4.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.12 -179.945 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.92 -33.59 64.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.15 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 405' ' ' GLU . . . . . 0.507 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.41 -47.17 44.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.95 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.78 -24.0 67.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.163 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.45 1.09 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.963 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.18 -17.14 12.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.821 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 409' ' ' TYR . . . . . 0.558 ' HH ' HD21 ' B' ' 449' ' ' LEU . 1.9 m-85 -106.66 -15.47 14.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.489 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.42 4.15 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.571 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 411' ' ' LEU . . . . . 0.422 ' HB3' HG21 ' B' ' 437' ' ' THR . 1.6 mm? -114.24 132.52 56.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.676 0.275 . . . . 0.0 111.052 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.45 115.41 48.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.084 0.469 . . . . 0.0 110.549 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . 0.603 ' HG3' HG23 ' B' ' 437' ' ' THR . 10.9 mttt -56.61 -62.06 1.99 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.168 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.96 -169.38 3.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.167 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 415' ' ' ILE . . . . . 0.571 HG22 HG13 ' B' ' 434' ' ' VAL . 48.5 mt -145.13 128.96 12.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.831 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 416' ' ' GLU . . . . . 0.418 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.9 108.82 18.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.733 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 417' ' ' ILE . . . . . 0.606 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.8 mt -128.55 108.57 19.01 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.644 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 418' ' ' PRO . . . . . 0.673 ' HD2' HG23 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.45 147.61 8.86 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.644 2.229 . . . . 0.0 112.916 -179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 419' ' ' ARG . . . . . 0.516 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.92 74.79 21.71 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.124 179.81 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -47.25 117.06 2.04 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.729 2.286 . . . . 0.0 112.472 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 421' ' ' VAL . . . . . 0.516 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.3 t -74.4 97.86 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.12 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.55 21.71 8.92 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.582 0.706 . . . . 0.0 109.374 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 423' ' ' GLY . . . . . 0.553 ' HA2' HG22 ' B' ' 426' ' ' VAL . . . 102.41 29.23 6.06 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.253 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 424' ' ' VAL . . . . . 0.516 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.48 -37.57 30.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.102 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.86 35.87 4.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.798 0.332 . . . . 0.0 111.809 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 426' ' ' VAL . . . . . 0.657 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.35 -44.68 47.72 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.775 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 427' ' ' PRO . . . . . 0.657 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.27 77.09 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.532 2.155 . . . . 0.0 111.08 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.27 -15.36 3.22 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.349 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.57 149.36 50.22 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.554 0.216 . . . . 0.0 110.864 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.17 5.06 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.842 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.4 126.04 44.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.856 0.36 . . . . 0.0 111.11 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 432' ' ' ILE . . . . . 0.673 HG23 ' HD2' ' B' ' 418' ' ' PRO . 7.8 pt -130.95 172.84 15.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.28 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 433' ' ' PHE . . . . . 0.554 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.43 -176.36 2.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.981 0.419 . . . . 0.0 112.027 -178.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 434' ' ' VAL . . . . . 0.571 HG13 HG22 ' B' ' 415' ' ' ILE . 3.3 m -135.79 141.76 41.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.211 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 435' ' ' GLU . . . . . 0.481 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.36 108.39 17.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.849 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.72 168.4 12.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.255 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 437' ' ' THR . . . . . 0.603 HG23 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.91 -45.44 7.28 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.455 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.87 146.59 52.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.028 0.442 . . . . 0.0 111.249 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.15 -12.74 16.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.238 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -54.79 26.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.015 0.436 . . . . 0.0 110.087 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -75.08 -29.54 60.7 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.829 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 442' ' ' CYS . . . . . 0.51 ' HB3' ' HH ' ' B' ' 463' ' ' TYR . 0.3 OUTLIER -62.2 -31.71 72.27 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.197 179.275 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.61 -48.12 15.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.666 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.55 -12.11 59.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.73 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.83 -55.34 3.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.946 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 446' ' ' MET . . . . . 0.475 ' HE1' ' HA ' ' B' ' 462' ' ' LYS . 3.3 ptm -65.02 -25.86 68.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.22 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.8 -16.2 62.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.606 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.62 22.55 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.418 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 449' ' ' LEU . . . . . 0.558 HD21 ' HH ' ' B' ' 409' ' ' TYR . 97.2 mt -95.66 -19.72 19.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.818 0.342 . . . . 0.0 110.99 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 16.0 m -72.85 125.94 28.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.206 -0.907 . . . . 0.0 111.038 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 98.5 -9.12 62.48 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.946 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -77.83 -152.15 0.05 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.865 0.332 . . . . 0.0 110.553 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 453' ' ' LYS . . . . . 0.464 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.13 2.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.791 0.329 . . . . 0.0 111.263 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.33 -36.33 75.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.55 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.22 -50.92 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.754 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.23 24.89 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.834 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 457' ' ' ARG . . . . . 0.408 ' NE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.41 132.39 16.19 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.253 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 5.6 p -66.37 112.64 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.552 0.691 . . . . 0.0 110.994 -177.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 459' ' ' VAL . . . . . 0.589 HG13 ' HZ3' ' A' ' 22' ' ' TRP . 1.9 p -73.0 124.03 29.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.736 -174.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 460' ' ' VAL . . . . . 0.599 HG23 HG23 ' A' ' 53' ' ' ILE . 66.9 t -92.55 102.53 13.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.868 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 72.8 p -92.82 153.91 18.57 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.744 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 462' ' ' LYS . . . . . 0.475 ' HA ' ' HE1' ' B' ' 446' ' ' MET . 0.1 OUTLIER -151.75 -168.41 3.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.082 0.468 . . . . 0.0 111.266 -177.714 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 463' ' ' TYR . . . . . 0.51 ' HH ' ' HB3' ' B' ' 442' ' ' CYS . 1.2 m-85 -112.44 146.91 37.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.411 177.48 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 464' ' ' CYS . . . . . 0.451 ' O ' HG21 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 148.98 47.43 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.071 0.463 . . . . 0.0 111.363 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 465' ' ' ASP . . . . . 0.45 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.32 129.32 66.96 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.377 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 466' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.3 Cg_endo -53.96 -33.32 71.95 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.708 2.272 . . . . 0.0 112.148 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.51 7.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.385 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.81 68.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.289 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 469' ' ' TYR . . . . . 0.481 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.0 -51.28 70.33 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.161 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.38 -47.51 69.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.335 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 471' ' ' ARG . . . . . 0.442 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.68 -2.18 49.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.438 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.1 20.77 8.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.007 0.432 . . . . 0.0 110.282 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 473' ' ' ASP . . . . . 0.442 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.62 -21.82 29.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.96 179.835 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 49.3 p90 . . . . . 0 N--CA 1.478 0.926 0 C-N-CA 124.652 1.181 . . . . 0.0 112.856 -175.274 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.6 p90 . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 120.449 0.166 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -57.29 115.49 2.54 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.993 2.462 . . . . 0.0 112.407 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.01 -166.7 1.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.836 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.31 51.96 12.22 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.935 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.43 -36.18 3.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.996 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.92 2.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.89 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.93 -54.26 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.734 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.13 13.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.57 24.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.816 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.84 19.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.038 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.581 ' HZ3' HG23 ' B' ' 459' ' ' VAL . 71.7 m95 -142.02 53.05 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.806 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.2 -156.59 0.13 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.889 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.46 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.27 -37.7 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.455 ' O ' ' HB ' ' A' ' 26' ' ' THR . 0.2 OUTLIER -114.72 125.72 54.05 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 118.826 -0.607 . . . . 0.0 110.607 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.455 ' HB ' ' O ' ' A' ' 25' ' ' ASP . 88.3 m . . . . . 0 N--CA 1.483 1.224 0 O-C-N 124.615 1.197 . . . . 0.0 110.778 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 CA--C 1.519 -0.248 0 CA-C-O 120.998 0.428 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.578 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 1.5 p -99.38 149.15 23.46 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.334 174.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.41 ' HD3' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -58.64 -31.32 68.02 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.329 -178.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.578 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.33 -45.18 61.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.16 -33.1 72.88 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.761 -177.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -61.24 -44.75 96.75 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.225 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.456 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.89 -43.39 98.93 Favored 'General case' 0 C--O 1.185 -2.316 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.248 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.456 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.26 -41.09 83.5 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 123.789 0.681 . . . . 0.0 111.626 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.79 -46.8 80.57 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.024 175.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.605 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 96.5 mt -64.49 -46.94 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.013 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 50' ' ' ARG . 34.9 m -68.04 -35.59 72.3 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.806 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.914 -177.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.12 -44.22 91.98 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.515 0.598 . . . . 0.0 110.349 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 1.7 pp -70.17 -28.55 65.42 Favored 'General case' 0 C--N 1.344 0.367 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.713 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.412 ' NE2' HD22 ' B' ' 382' ' ' ASN . 91.3 mt-30 -77.86 -34.68 51.64 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 120.873 0.368 . . . . 0.0 110.167 176.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.481 HD13 HD13 ' A' ' 113' ' ' ILE . 72.5 mt -62.9 -46.94 95.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.382 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.452 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.48 -41.28 84.84 Favored 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.703 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -68.31 -33.35 74.16 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.199 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.521 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.47 -44.98 77.28 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 173.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 m -65.63 -35.61 81.29 Favored 'General case' 0 N--CA 1.433 -1.305 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -178.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.462 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.82 -42.86 76.33 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 122.068 0.937 . . . . 0.0 108.495 176.158 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.521 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.71 -47.78 83.72 Favored 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.873 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.18 -28.86 63.49 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.856 177.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -67.97 -47.12 69.45 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.462 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.5 14.46 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -177.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.43 10.76 Favored Glycine 0 C--N 1.316 -0.57 0 C-N-CA 119.916 -1.135 . . . . 0.0 111.295 -177.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.34 88.85 6.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.258 0.552 . . . . 0.0 110.094 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 26.5 tp . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.544 176.935 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.1 t . . . . . 0 N--CA 1.435 -1.201 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.16 -52.52 16.21 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.247 -0.908 . . . . 0.0 109.692 -178.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.6 mp0 -53.3 -51.67 61.58 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.614 -1.63 . . . . 0.0 110.714 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -66.78 -38.56 86.8 Favored 'General case' 0 N--CA 1.427 -1.59 0 CA-C-N 113.42 -1.718 . . . . 0.0 110.681 -177.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.506 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.89 -44.57 94.16 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.267 0.355 . . . . 0.0 110.379 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.71 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 16.0 m -69.01 -50.01 52.67 Favored 'General case' 0 N--CA 1.428 -1.561 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.649 179.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.4 -41.36 93.75 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -175.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.01 -39.15 90.02 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 110.381 -0.229 . . . . 0.0 110.381 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.517 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.15 -40.17 88.96 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.71 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.93 -41.02 97.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.719 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.12 -34.39 78.28 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.707 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.31 74.2 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.517 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.51 -48.84 75.95 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 175.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.543 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.32 -45.44 94.43 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.404 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.21 -37.51 85.6 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 123.603 0.761 . . . . 0.0 110.991 -178.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.84 -43.73 86.06 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.2 mt -72.21 -38.61 68.97 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.753 177.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.543 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.39 -50.86 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 120.464 0.173 . . . . 0.0 110.544 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.3 m -60.63 -39.58 88.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.221 0.534 . . . . 0.0 110.548 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.593 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.55 61.04 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.981 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.11 84.48 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.3 t -65.49 -36.88 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.19 0.519 . . . . 0.0 109.642 176.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.61 -40.77 80.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.171 0.51 . . . . 0.0 110.26 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.2 mt -71.33 -40.69 70.58 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.069 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -133.53 111.14 12.57 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.323 -0.398 . . . . 0.0 109.992 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.69 -22.72 37.06 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.885 2.39 . . . . 0.0 112.57 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.24 0.04 55.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.35 0.595 . . . . 0.0 111.198 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.85 134.58 54.36 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.673 -178.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.36 109.18 62.91 Favored Pre-proline 0 CA--C 1.509 -0.615 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.308 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.29 157.97 59.52 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.247 1.965 . . . . 0.0 111.419 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.65 154.51 25.28 Favored 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 123.673 2.915 . . . . 0.0 111.737 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.31 69.38 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -173.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -85.45 34.11 0.57 Allowed 'General case' 0 CA--C 1.532 0.288 0 O-C-N 123.603 0.564 . . . . 0.0 111.224 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 56.3 t80 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.52 177.43 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 C--O 1.232 0.224 0 CA-C-O 120.523 0.135 . . . . 0.0 111.756 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 375' ' ' THR . . . . . 0.44 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -119.67 -71.33 0.74 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.124 177.903 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 376' ' ' GLU . . . . . 0.479 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.88 -45.96 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 377' ' ' VAL . . . . . 0.436 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.66 150.98 7.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.431 -179.411 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 378' ' ' LEU . . . . . 0.551 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.72 152.54 20.78 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.182 -179.026 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 379' ' ' CYS . . . . . 0.572 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.52 142.6 46.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.623 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . 0.427 HD12 HG11 ' B' ' 434' ' ' VAL . 5.3 mt -132.74 101.27 5.21 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.0 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 381' ' ' MET . . . . . 0.753 ' HE3' ' HG2' ' B' ' 431' ' ' LYS . 43.3 ttm -118.02 165.58 13.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.784 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 382' ' ' ASN . . . . . 0.412 HD22 ' NE2' ' A' ' 57' ' ' GLN . 13.4 t30 59.07 51.22 7.3 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 123.635 0.584 . . . . 0.0 111.273 -178.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 383' ' ' MET . . . . . 0.679 ' HB3' HG13 ' B' ' 459' ' ' VAL . 3.0 ptm -164.89 14.4 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.233 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 384' ' ' VAL . . . . . 0.478 HG13 HD11 ' B' ' 398' ' ' ILE . 0.5 OUTLIER -152.3 125.09 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 0.0 111.42 179.865 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . . . . . . . . . 20.2 mt -110.66 151.81 43.05 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.389 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -63.26 -23.49 72.39 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.293 1.995 . . . . 0.0 112.293 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.78 -5.5 53.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.552 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -110.15 -36.69 5.77 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.9 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 389' ' ' LEU . . . . . 0.46 HD12 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.99 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.997 0.427 . . . . 0.0 110.616 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 390' ' ' LEU . . . . . 0.521 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.52 -15.81 5.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.652 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -98.31 148.83 23.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.565 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -73.63 -30.16 62.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.201 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.42 -47.59 26.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.001 0.429 . . . . 0.0 110.765 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.56 -44.33 91.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.748 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.27 -59.43 4.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.245 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.06 -27.31 61.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.185 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -40.99 67.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.405 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 398' ' ' ILE . . . . . 0.478 HD11 HG13 ' B' ' 384' ' ' VAL . 65.1 mt -74.88 -53.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.505 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 399' ' ' VAL . . . . . 0.581 HG23 HD12 ' B' ' 417' ' ' ILE . 59.6 t -53.31 -46.98 57.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.775 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.94 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.756 0.312 . . . . 0.0 111.548 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.65 -57.25 11.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.288 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.04 -32.9 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.391 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 403' ' ' ARG . . . . . 0.438 ' HA ' HD12 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.21 -57.31 4.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.824 0.345 . . . . 0.0 111.214 -179.989 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.95 -33.64 64.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.122 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 405' ' ' GLU . . . . . 0.517 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.53 -47.05 43.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.919 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.87 -23.97 67.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.148 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.07 30.41 1.09 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.981 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.15 -17.11 12.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 409' ' ' TYR . . . . . 0.534 ' HH ' HD21 ' B' ' 449' ' ' LEU . 1.8 m-85 -106.7 -15.48 14.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.535 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.37 4.12 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.627 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 411' ' ' LEU . . . . . 0.428 ' HB3' HG21 ' B' ' 437' ' ' THR . 1.6 mm? -114.26 132.51 56.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.612 0.244 . . . . 0.0 111.083 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.51 115.47 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.101 0.477 . . . . 0.0 110.532 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . 0.595 ' HG3' HG23 ' B' ' 437' ' ' THR . 10.8 mttt -56.6 -61.93 2.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.239 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.9 p -153.05 -169.38 3.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.171 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 415' ' ' ILE . . . . . 0.591 HG22 HG12 ' B' ' 434' ' ' VAL . 48.5 mt -145.12 128.96 12.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.848 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 416' ' ' GLU . . . . . 0.411 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.91 108.77 18.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.68 179.792 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 417' ' ' ILE . . . . . 0.599 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.7 mt -128.51 108.63 19.09 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.663 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 418' ' ' PRO . . . . . 0.646 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.61 147.7 9.2 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.587 2.191 . . . . 0.0 112.919 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 419' ' ' ARG . . . . . 0.521 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.92 74.67 21.85 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.13 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -47.08 117.11 2.02 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.752 2.302 . . . . 0.0 112.407 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 421' ' ' VAL . . . . . 0.52 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.6 t -74.43 97.84 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.942 0.401 . . . . 0.0 111.2 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.51 21.85 9.01 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.49 0.662 . . . . 0.0 109.321 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 423' ' ' GLY . . . . . 0.569 ' HA2' HG22 ' B' ' 426' ' ' VAL . . . 102.28 29.26 6.09 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-N 114.755 -1.111 . . . . 0.0 111.346 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 424' ' ' VAL . . . . . 0.52 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.41 -37.6 31.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.84 35.86 4.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.817 0.342 . . . . 0.0 111.805 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 426' ' ' VAL . . . . . 0.645 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.37 -44.72 47.55 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.755 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 427' ' ' PRO . . . . . 0.645 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.24 77.11 0.33 Allowed 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.5 2.134 . . . . 0.0 111.053 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.31 -15.42 3.21 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.358 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.9 t -67.64 149.39 50.12 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.519 0.199 . . . . 0.0 110.766 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.51 -14.14 5.07 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.854 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 431' ' ' LYS . . . . . 0.753 ' HG2' ' HE3' ' B' ' 381' ' ' MET . 0.0 OUTLIER -125.45 126.07 44.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.774 0.321 . . . . 0.0 111.072 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 432' ' ' ILE . . . . . 0.646 HG22 ' HD2' ' B' ' 418' ' ' PRO . 7.9 pt -131.02 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.258 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 433' ' ' PHE . . . . . 0.572 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.38 2.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.032 0.444 . . . . 0.0 111.926 -178.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 434' ' ' VAL . . . . . 0.591 HG12 HG22 ' B' ' 415' ' ' ILE . 3.2 m -135.84 141.69 41.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.207 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 435' ' ' GLU . . . . . 0.48 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.38 108.63 17.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.833 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.82 168.41 12.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.239 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 437' ' ' THR . . . . . 0.595 HG23 ' HG3' ' B' ' 413' ' ' LYS . 27.1 p -94.93 -45.39 7.29 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.519 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.84 146.66 52.25 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.057 0.456 . . . . 0.0 111.216 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.26 -12.75 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.212 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.64 -54.86 25.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.156 0.503 . . . . 0.0 110.132 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -75.1 -29.44 60.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.859 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -31.72 72.3 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.22 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.64 -48.07 15.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.63 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.63 -12.04 59.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.762 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -56.03 3.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.914 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 446' ' ' MET . . . . . 0.551 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.6 OUTLIER -62.88 -28.07 69.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.464 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.67 -16.18 63.31 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.598 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.65 -8.59 22.51 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.408 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 449' ' ' LEU . . . . . 0.534 HD21 ' HH ' ' B' ' 409' ' ' TYR . 97.2 mt -95.73 -19.7 19.47 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.764 0.316 . . . . 0.0 110.915 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 4.4 t -76.78 129.32 36.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.131 0.491 . . . . 0.0 110.956 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 97.08 -10.22 65.69 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.994 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -76.09 -152.2 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 117.081 0.44 . . . . 0.0 110.492 178.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 453' ' ' LYS . . . . . 0.46 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.84 117.06 2.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.859 0.361 . . . . 0.0 111.306 -179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.17 -36.38 75.2 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.537 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.28 -50.96 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.788 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.17 24.94 0.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.704 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 457' ' ' ARG . . . . . 0.414 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.57 135.4 18.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.244 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 14.7 p -59.86 139.06 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.666 177.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 459' ' ' VAL . . . . . 0.679 HG13 ' HB3' ' B' ' 383' ' ' MET . 14.7 m -102.18 125.85 56.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.258 0.551 . . . . 0.0 111.843 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 460' ' ' VAL . . . . . 0.605 HG23 HG22 ' A' ' 53' ' ' ILE . 77.7 t -91.65 103.01 14.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.058 175.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 35.7 p -106.77 113.12 26.42 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.053 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 462' ' ' LYS . . . . . 0.49 ' HB2' ' H ' ' B' ' 463' ' ' TYR . 5.5 pttm -121.28 -157.33 0.72 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.343 0.592 . . . . 0.0 111.727 -178.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 463' ' ' TYR . . . . . 0.49 ' H ' ' HB2' ' B' ' 462' ' ' LYS . 1.3 m-85 -114.88 146.97 40.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.581 -172.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 464' ' ' CYS . . . . . 0.436 ' O ' HG21 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.86 149.07 47.47 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.131 0.491 . . . . 0.0 111.284 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 465' ' ' ASP . . . . . 0.44 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.44 129.36 66.41 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.351 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 466' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.3 Cg_endo -54.05 -33.32 72.96 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.763 2.309 . . . . 0.0 112.12 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.94 -58.52 7.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.445 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.41 -33.82 68.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.282 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 469' ' ' TYR . . . . . 0.48 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -59.96 -51.28 70.35 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.177 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.31 -47.55 69.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.358 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 471' ' ' ARG . . . . . 0.461 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.15 49.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.383 -179.862 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.09 20.84 8.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.917 0.389 . . . . 0.0 110.247 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 473' ' ' ASP . . . . . 0.461 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.78 -20.67 23.63 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.94 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.533 0.309 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.294 -178.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.456 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 15.0 m-85 . . . . . 0 C--O 1.231 0.092 0 N-CA-C 110.469 -0.197 . . . . 0.0 110.469 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 39.1 Cg_exo -56.54 115.53 2.54 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.287 2.658 . . . . 0.0 112.354 -173.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.01 -166.75 1.32 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.85 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.38 51.93 12.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.41 -36.23 3.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.974 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.84 2.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.92 -54.2 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.783 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.83 111.22 13.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.03 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.57 24.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.739 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.55 12.79 19.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.995 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.508 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.7 m95 -142.05 53.05 1.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.994 0.426 . . . . 0.0 110.83 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.2 -156.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.885 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.458 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.35 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.883 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.83 124.67 52.34 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-O 118.93 -0.557 . . . . 0.0 110.57 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.364 0 O-C-N 123.872 0.732 . . . . 0.0 110.041 172.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.459 ' HB3' ' HG3' ' A' ' 49' ' ' GLU . 3.8 mm? . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.769 0.318 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.438 ' HG1' ' H ' ' A' ' 48' ' ' GLN . 54.7 p -79.19 159.07 27.53 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -31.32 71.01 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 120.878 0.37 . . . . 0.0 111.305 -175.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -72.27 -45.12 61.48 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.438 ' H ' ' HG1' ' A' ' 45' ' ' THR . 5.2 tp-100 -69.3 -33.28 72.93 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.695 -177.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.459 ' HG3' ' HB3' ' A' ' 44' ' ' LEU . 35.6 mt-10 -60.56 -45.21 94.75 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.145 177.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.446 ' O ' HG22 ' A' ' 54' ' ' VAL . 16.0 mmt180 -62.81 -43.32 99.11 Favored 'General case' 0 C--O 1.185 -2.327 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.211 177.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.453 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.42 -41.44 85.03 Favored 'General case' 0 C--N 1.32 -0.699 0 O-C-N 123.78 0.675 . . . . 0.0 111.632 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -65.3 -44.76 86.88 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.842 177.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.686 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 92.2 mt -69.18 -44.83 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.309 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.453 HG22 ' HA ' ' A' ' 51' ' ' ALA . 35.1 m -67.05 -35.49 74.66 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.71 0 CA-C-O 118.656 -0.688 . . . . 0.0 111.873 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.18 -44.77 92.17 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.595 0.634 . . . . 0.0 110.335 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.686 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 3.3 pp -72.12 -23.17 61.28 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.125 -178.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -85.86 -30.67 22.73 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.199 175.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 54' ' ' VAL . 73.2 mt -62.59 -47.01 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.07 0.548 . . . . 0.0 110.411 172.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.471 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.34 -41.72 84.75 Favored 'General case' 0 CA--C 1.512 -0.482 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.667 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -68.53 -32.82 73.04 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.37 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.528 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.37 -45.1 77.27 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 173.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 m -65.47 -35.76 81.87 Favored 'General case' 0 N--CA 1.433 -1.288 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.42 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.73 -42.82 75.92 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.528 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.0 ttmt -61.83 -47.68 84.01 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.798 -1.546 . . . . 0.0 111.913 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.21 -28.86 63.45 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 119.758 -0.777 . . . . 0.0 111.888 176.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.92 -47.25 69.27 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.42 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.11 -17.51 14.46 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.926 -0.709 . . . . 0.0 112.904 -177.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.75 29.49 10.67 Favored Glycine 0 C--N 1.316 -0.528 0 C-N-CA 119.887 -1.149 . . . . 0.0 111.307 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.42 93.16 7.16 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.244 0.545 . . . . 0.0 110.261 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 23.3 tp . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.68 178.166 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.436 -1.138 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.19 -52.56 15.98 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.273 -0.892 . . . . 0.0 109.598 -178.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.6 mp0 -53.27 -51.75 61.27 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-N 113.616 -1.629 . . . . 0.0 110.614 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.77 -38.61 86.92 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.482 -1.69 . . . . 0.0 110.626 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.509 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.92 -44.6 94.21 Favored 'General case' 0 CA--C 1.51 -0.563 0 O-C-N 123.182 0.302 . . . . 0.0 110.38 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.704 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.6 m -68.95 -50.03 52.8 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.679 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.37 -41.32 93.91 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 -175.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.97 -39.24 90.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.595 0.236 . . . . 0.0 110.373 178.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.17 -40.19 89.07 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.89 -41.08 97.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.7 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.06 -34.32 78.13 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.734 178.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.39 74.31 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 177.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.46 -48.8 76.21 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 175.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.54 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.23 -45.59 93.92 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.405 179.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.26 -37.41 85.35 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 123.579 0.751 . . . . 0.0 111.019 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.79 -43.81 85.85 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 177.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.5 mt -72.17 -38.67 69.07 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.157 -0.928 . . . . 0.0 110.75 177.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.54 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.35 -50.88 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 N-CA-C 110.488 -0.19 . . . . 0.0 110.488 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 96.0 m -60.79 -39.44 88.9 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.272 0.558 . . . . 0.0 110.589 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.601 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.88 -49.55 61.39 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.063 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.4 -37.11 84.51 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -177.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.1 t -65.57 -36.81 78.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.63 -40.78 80.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.206 0.527 . . . . 0.0 110.231 177.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.2 mt -71.4 -40.65 70.39 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.019 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.57 111.22 12.54 Favored Pre-proline 0 C--N 1.317 -0.834 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.79 -22.66 36.55 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.765 2.31 . . . . 0.0 112.531 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.24 0.06 55.95 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.353 0.596 . . . . 0.0 111.175 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.91 134.64 54.42 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.61 -178.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.43 109.21 62.95 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.251 177.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.26 157.89 59.86 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.305 2.004 . . . . 0.0 111.516 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.57 154.5 24.88 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 123.603 2.869 . . . . 0.0 111.809 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.16 -28.59 67.42 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -173.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -71.61 -12.36 61.31 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -164.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 10.4 t80 . . . . . 0 C--N 1.327 -0.399 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.187 176.751 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.456 -0.723 0 CA-C-O 121.053 0.355 . . . . 0.0 112.363 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 375' ' ' THR . . . . . 0.443 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -127.5 -71.23 0.67 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.123 175.253 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 376' ' ' GLU . . . . . 0.474 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.85 -45.98 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 377' ' ' VAL . . . . . 0.441 HG23 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.99 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.465 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 378' ' ' LEU . . . . . 0.511 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.61 152.51 20.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.233 -179.057 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 379' ' ' CYS . . . . . 0.578 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.55 142.59 46.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.629 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . 0.437 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.76 101.72 5.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.91 0.385 . . . . 0.0 110.958 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 381' ' ' MET . . . . . 0.535 ' HE3' ' HG2' ' B' ' 431' ' ' LYS . 85.3 mtp -119.12 166.43 12.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.97 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.7 51.26 7.88 Favored 'General case' 0 C--O 1.232 0.133 0 O-C-N 123.821 0.7 . . . . 0.0 111.345 -178.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 383' ' ' MET . . . . . 0.463 ' HE3' HD13 ' B' ' 432' ' ' ILE . 3.0 ptm -164.88 14.41 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.237 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 384' ' ' VAL . . . . . 0.502 HG23 HG22 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.3 125.01 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.382 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . . . . . . . . . 20.1 mt -110.61 151.78 43.01 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.468 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.2 -23.4 72.77 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.323 2.015 . . . . 0.0 112.279 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.9 -5.53 53.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.526 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.13 -36.71 5.77 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.848 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 389' ' ' LEU . . . . . 0.443 HD13 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.99 34.95 0.46 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.008 0.432 . . . . 0.0 110.669 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 390' ' ' LEU . . . . . 0.52 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.53 -15.72 5.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.693 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -98.34 148.77 23.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.553 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -73.55 -30.29 62.97 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.203 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -75.38 -47.58 26.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.768 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.63 -44.21 91.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.802 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.37 -59.47 4.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.193 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -27.32 61.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.234 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.17 -40.99 67.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.471 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 398' ' ' ILE . . . . . 0.474 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.91 -53.61 16.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.539 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 399' ' ' VAL . . . . . 0.559 HG23 HD13 ' B' ' 417' ' ' ILE . 59.3 t -53.4 -46.84 58.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.801 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.51 -59.94 3.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.52 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.68 -57.08 12.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.441 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.14 -32.86 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.346 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 403' ' ' ARG . . . . . 0.44 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.22 -57.42 4.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.766 0.317 . . . . 0.0 111.113 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.96 -33.68 64.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.127 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 405' ' ' GLU . . . . . 0.508 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 22.0 mm-40 -73.39 -47.02 45.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.981 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.85 -23.98 67.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.187 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.14 30.37 1.11 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.932 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.09 -17.12 12.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 409' ' ' TYR . . . . . 0.575 ' HH ' HD21 ' B' ' 449' ' ' LEU . 1.9 m-85 -106.69 -15.45 14.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.493 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.17 -139.4 4.14 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.61 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 411' ' ' LEU . . . . . 0.424 ' HB3' HG21 ' B' ' 437' ' ' THR . 1.6 mm? -114.25 132.47 56.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.677 0.275 . . . . 0.0 111.07 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.4 p -117.43 115.45 48.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.02 0.438 . . . . 0.0 110.653 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . 0.602 ' HG3' HG23 ' B' ' 437' ' ' THR . 10.9 mttt -56.62 -61.97 2.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.177 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.7 p -153.07 -169.44 3.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.049 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 415' ' ' ILE . . . . . 0.593 HG22 HG11 ' B' ' 434' ' ' VAL . 48.4 mt -145.0 128.89 12.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.945 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 416' ' ' GLU . . . . . 0.403 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.84 108.79 18.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.889 0.376 . . . . 0.0 110.702 179.811 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 417' ' ' ILE . . . . . 0.587 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.4 mt -128.49 108.59 19.11 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.675 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 418' ' ' PRO . . . . . 0.645 ' HD2' HG23 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.54 147.62 9.1 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 122.669 2.246 . . . . 0.0 112.855 -179.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 419' ' ' ARG . . . . . 0.52 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.87 74.64 22.05 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.107 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.16 117.07 2.02 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.732 2.288 . . . . 0.0 112.477 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 421' ' ' VAL . . . . . 0.522 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.6 t -74.39 97.82 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.178 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.62 21.77 9.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.535 0.684 . . . . 0.0 109.298 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 423' ' ' GLY . . . . . 0.563 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.23 29.25 6.11 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.377 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 424' ' ' VAL . . . . . 0.522 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.45 -37.47 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.9 35.81 4.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.745 0.307 . . . . 0.0 111.745 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 426' ' ' VAL . . . . . 0.641 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.31 -44.69 48.1 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.792 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 427' ' ' PRO . . . . . 0.641 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.9 Cg_endo -66.25 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.491 2.128 . . . . 0.0 111.088 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.26 -15.44 3.22 Favored Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.344 -178.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.58 149.38 50.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.68 0.276 . . . . 0.0 110.771 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.13 5.06 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.845 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 431' ' ' LYS . . . . . 0.535 ' HG2' ' HE3' ' B' ' 381' ' ' MET . 0.0 OUTLIER -125.42 126.11 44.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.836 0.351 . . . . 0.0 111.108 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 432' ' ' ILE . . . . . 0.645 HG23 ' HD2' ' B' ' 418' ' ' PRO . 7.8 pt -131.06 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.231 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 433' ' ' PHE . . . . . 0.578 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.47 -176.36 2.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.982 0.42 . . . . 0.0 111.939 -178.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 434' ' ' VAL . . . . . 0.593 HG11 HG22 ' B' ' 415' ' ' ILE . 3.3 m -135.87 141.75 41.02 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.145 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 435' ' ' GLU . . . . . 0.473 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.36 108.5 17.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.845 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.76 168.29 12.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.251 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 437' ' ' THR . . . . . 0.602 HG23 ' HG3' ' B' ' 413' ' ' LYS . 27.0 p -94.86 -45.42 7.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.517 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.89 146.57 52.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.99 0.424 . . . . 0.0 111.25 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.19 -12.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.236 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -54.86 25.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.149 0.5 . . . . 0.0 110.043 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.13 -29.5 60.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.829 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.12 -31.86 72.37 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.19 179.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.61 -48.01 15.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.641 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.63 -12.02 59.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.738 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -55.73 3.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.902 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 446' ' ' MET . . . . . 0.542 ' HE1' ' HA ' ' B' ' 462' ' ' LYS . 0.3 OUTLIER -63.69 -27.46 69.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.25 -179.678 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.87 -16.33 63.23 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.574 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.64 22.53 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.425 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 449' ' ' LEU . . . . . 0.575 HD21 ' HH ' ' B' ' 409' ' ' TYR . 97.2 mt -95.61 -19.52 19.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.784 0.326 . . . . 0.0 111.004 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 1.7 t -72.37 132.28 43.74 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.894 176.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 92.45 -9.55 75.78 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.299 178.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -77.07 -152.25 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 117.313 0.556 . . . . 0.0 110.525 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 453' ' ' LYS . . . . . 0.458 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.8 117.1 2.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.884 0.373 . . . . 0.0 111.331 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.27 -36.32 75.33 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.549 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.833 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.19 24.91 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.731 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 457' ' ' ARG . . . . . 0.411 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.48 135.73 19.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.301 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 14.8 p -60.83 137.28 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.968 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 45.0 t -99.77 115.36 40.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.414 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 460' ' ' VAL . . . . . 0.466 HG23 HG21 ' A' ' 53' ' ' ILE . 39.7 t -84.88 102.76 11.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.959 176.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 21.4 p -102.68 123.13 45.8 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.377 -177.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 462' ' ' LYS . . . . . 0.542 ' HA ' ' HE1' ' B' ' 446' ' ' MET . 0.0 OUTLIER -130.56 -159.38 0.96 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.279 0.562 . . . . 0.0 111.758 -179.485 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 463' ' ' TYR . . . . . 0.467 ' CD2' ' HE2' ' B' ' 446' ' ' MET . 1.3 m-85 -114.7 147.0 40.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.667 -171.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 464' ' ' CYS . . . . . 0.441 ' O ' HG23 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.9 148.98 47.36 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.068 0.461 . . . . 0.0 111.382 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 465' ' ' ASP . . . . . 0.443 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.36 129.37 66.64 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.378 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 466' ' ' PRO . . . . . 0.474 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.1 -33.24 73.14 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.677 2.251 . . . . 0.0 112.07 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.46 7.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.43 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.82 68.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.281 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 469' ' ' TYR . . . . . 0.473 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.03 -51.25 70.45 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.156 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -53.32 -47.52 69.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.4 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 471' ' ' ARG . . . . . 0.461 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.75 -2.06 49.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.415 -179.895 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.1 20.8 8.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.876 0.37 . . . . 0.0 110.236 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 473' ' ' ASP . . . . . 0.461 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.83 -19.85 19.58 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.927 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 . . . . . 0 N--CA 1.477 0.908 0 C-N-CA 123.014 0.526 . . . . 0.0 112.043 179.31 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.363 0.125 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -56.65 115.65 2.63 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 123.04 2.493 . . . . 0.0 112.205 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.0 -166.77 1.33 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.903 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.39 51.91 12.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.908 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.36 -36.18 3.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.05 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.84 91.91 2.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.87 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.89 -54.27 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.796 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.82 111.19 13.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.941 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.61 24.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.726 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.67 12.83 19.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.94 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.526 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.7 m95 -142.02 53.07 1.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.773 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.25 -156.56 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.459 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.31 -37.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.857 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.431 ' OD1' ' NZ ' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -114.64 119.65 37.48 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.518 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.51 0 O-C-N 123.982 0.802 . . . . 0.0 109.854 -171.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.412 HD11 ' HA ' ' A' ' 44' ' ' LEU . 3.2 mm? . . . . . 0 C--O 1.233 0.195 0 CA-C-O 121.015 0.436 . . . . 0.0 111.659 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.496 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 16.1 p -89.75 158.0 17.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.163 174.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.412 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.78 -31.43 71.63 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 120.956 0.407 . . . . 0.0 111.317 -176.107 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.496 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.27 -45.22 61.05 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -69.14 -33.03 72.8 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.796 -177.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -62.2 -42.91 99.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.419 178.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.498 ' NH1' HD22 ' B' ' 382' ' ' ASN . 15.9 mmt180 -64.03 -43.36 95.8 Favored 'General case' 0 C--O 1.185 -2.302 0 CA-C-O 118.803 -0.618 . . . . 0.0 110.274 176.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.439 ' HA ' HG21 ' A' ' 54' ' ' VAL . . . -58.35 -41.87 85.66 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 123.792 0.683 . . . . 0.0 111.583 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -65.73 -43.19 89.79 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.744 0.307 . . . . 0.0 110.999 176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.781 ' HA ' HD23 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -73.22 -38.49 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.465 -178.708 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.439 HG21 ' HA ' ' A' ' 51' ' ' ALA . 35.1 m -70.34 -35.52 62.93 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.788 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.881 177.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.13 -43.89 92.02 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.591 0.632 . . . . 0.0 110.275 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.781 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.6 OUTLIER -65.24 -34.11 77.58 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.946 178.069 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -80.87 -29.23 35.77 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 54' ' ' VAL . 73.0 mt -65.08 -47.06 89.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.348 174.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.4 -41.93 84.11 Favored 'General case' 0 CA--C 1.513 -0.45 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.697 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -58.84 -43.78 90.79 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 124.887 1.367 . . . . 0.0 110.843 176.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -66.01 -44.94 83.31 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.401 178.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.468 ' HG1' ' HD3' ' A' ' 109' ' ' ARG . 24.0 m -65.56 -35.7 81.62 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -178.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.432 ' O ' HG22 ' A' ' 67' ' ' THR . 39.3 ttp180 -55.89 -42.68 76.34 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 122.069 0.937 . . . . 0.0 108.509 176.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.519 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.84 -47.78 83.53 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.836 -1.529 . . . . 0.0 111.883 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.16 -28.91 63.54 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 119.754 -0.778 . . . . 0.0 111.791 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -68.02 -47.1 69.38 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.11 -17.59 14.43 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 120.002 -0.679 . . . . 0.0 112.821 -177.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.8 29.44 10.66 Favored Glycine 0 C--N 1.315 -0.631 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.252 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.27 92.56 6.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.174 0.511 . . . . 0.0 110.268 -179.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.411 HD12 HD21 ' A' ' 105' ' ' LEU . 3.0 mm? . . . . . 0 N--CA 1.45 -0.435 0 CA-C-N 114.009 -1.45 . . . . 0.0 109.884 175.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.436 -1.157 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.15 -52.51 16.31 Favored 'General case' 0 C--N 1.306 -1.323 0 O-C-N 121.237 -0.914 . . . . 0.0 109.604 -178.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -53.19 -51.77 61.03 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.704 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.68 -38.74 87.42 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 113.355 -1.748 . . . . 0.0 110.666 -177.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.93 -44.48 94.32 Favored 'General case' 0 CA--C 1.511 -0.537 0 O-C-N 123.17 0.294 . . . . 0.0 110.384 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.715 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.7 m -68.94 -50.13 51.96 Favored 'General case' 0 N--CA 1.429 -1.521 0 C-N-CA 120.104 -0.638 . . . . 0.0 110.644 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.41 -41.27 93.76 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -175.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.9 -39.27 90.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.588 0.232 . . . . 0.0 110.384 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.514 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.2 -40.13 88.99 Favored 'General case' 0 C--O 1.225 -0.235 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.8 mt -64.04 -40.98 97.51 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.673 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.04 -34.35 78.23 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.785 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.4 74.32 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 177.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.5 -48.82 76.04 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 175.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.537 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.21 -45.54 94.16 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.396 179.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.26 -37.4 85.33 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.016 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.82 -43.8 86.0 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 66.1 mt -72.19 -38.64 69.03 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.723 177.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.44 -50.77 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-O 120.474 0.178 . . . . 0.0 110.554 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.8 m -60.79 -39.49 89.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.301 0.572 . . . . 0.0 110.544 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.588 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.9 -49.63 60.88 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.015 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.35 -37.14 84.65 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -177.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.7 t -65.54 -36.83 78.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.61 -40.79 80.23 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.23 0.538 . . . . 0.0 110.213 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.5 mt -71.41 -40.69 70.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.006 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.57 111.24 12.54 Favored Pre-proline 0 C--N 1.315 -0.894 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.011 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.76 -22.7 36.69 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.836 2.357 . . . . 0.0 112.516 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.29 0.12 55.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.379 0.609 . . . . 0.0 111.203 -177.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.86 134.62 54.43 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.66 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.4 109.08 62.81 Favored Pre-proline 0 CA--C 1.509 -0.609 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.302 177.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -68.26 157.92 59.72 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.275 1.984 . . . . 0.0 111.503 178.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.58 154.5 24.89 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 123.615 2.877 . . . . 0.0 111.786 177.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.93 -30.17 69.41 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -173.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -75.96 -13.21 60.24 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 123.451 0.469 . . . . 0.0 111.748 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 58.4 t80 . . . . . 0 N--CA 1.465 0.298 0 CA-C-O 121.0 0.429 . . . . 0.0 111.491 -179.41 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo . . . . . 0 CA--C 1.531 0.329 0 N-CA-C 113.846 0.672 . . . . 0.0 113.846 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 375' ' ' THR . . . . . 0.449 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -115.63 -71.39 0.74 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.143 173.057 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 376' ' ' GLU . . . . . 0.473 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.92 0.01 OUTLIER 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 377' ' ' VAL . . . . . 0.442 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.64 151.0 7.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.432 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 378' ' ' LEU . . . . . 0.52 HD23 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.66 152.58 20.79 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.197 -179.055 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 379' ' ' CYS . . . . . 0.565 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.64 142.57 46.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.599 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . 0.523 HD21 HG22 ' B' ' 461' ' ' THR . 5.3 mt -132.76 101.18 5.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 381' ' ' MET . . . . . 0.435 ' HB3' ' HB ' ' B' ' 460' ' ' VAL . 18.3 ttp -116.65 165.92 12.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.596 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 382' ' ' ASN . . . . . 0.498 HD22 ' NH1' ' A' ' 50' ' ' ARG . 13.3 t30 58.31 51.13 8.69 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 123.536 0.523 . . . . 0.0 111.256 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 383' ' ' MET . . . . . 0.404 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.81 14.32 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.271 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 384' ' ' VAL . . . . . 0.483 HG11 HD11 ' B' ' 398' ' ' ILE . 0.4 OUTLIER -152.3 125.13 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.829 0.347 . . . . 0.0 111.326 179.878 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.67 151.74 43.01 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.406 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.1 -23.46 73.38 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.265 1.976 . . . . 0.0 112.352 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.86 -5.53 53.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.04 -36.69 5.79 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.909 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 389' ' ' LEU . . . . . 0.445 HD13 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -83.05 34.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.946 0.403 . . . . 0.0 110.603 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 390' ' ' LEU . . . . . 0.502 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.47 -15.73 5.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.726 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -98.28 148.74 23.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.582 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -73.56 -30.34 62.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.186 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.31 -47.68 26.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.729 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.48 -44.33 91.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.801 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -56.4 -59.4 5.02 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.211 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -27.35 61.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.23 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -40.99 67.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.42 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 398' ' ' ILE . . . . . 0.483 HD11 HG11 ' B' ' 384' ' ' VAL . 65.4 mt -74.9 -53.68 15.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.513 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 399' ' ' VAL . . . . . 0.582 HG22 HD12 ' B' ' 417' ' ' ILE . 59.5 t -53.34 -46.86 58.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.795 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.51 -59.92 3.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.516 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.68 -57.13 11.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.385 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.14 -32.83 15.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.375 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 403' ' ' ARG . . . . . 0.446 ' HA ' HD12 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.21 -57.43 4.5 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.746 0.307 . . . . 0.0 111.145 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.88 -33.64 64.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.177 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 405' ' ' GLU . . . . . 0.526 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.5 -47.02 44.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.978 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.83 -23.97 67.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.164 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 407' ' ' SER . . . . . 0.469 ' HG ' HG13 ' B' ' 412' ' ' VAL . 0.3 OUTLIER -90.04 30.27 1.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.972 -179.915 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.11 -17.07 12.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.89 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.67 -15.52 14.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.52 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.41 4.14 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.601 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 411' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.25 132.47 56.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.319 . . . . 0.0 111.086 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 412' ' ' VAL . . . . . 0.469 HG13 ' HG ' ' B' ' 407' ' ' SER . 7.5 p -117.39 115.49 48.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.061 0.457 . . . . 0.0 110.593 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . 0.608 ' HG3' HG23 ' B' ' 437' ' ' THR . 10.9 mttt -56.63 -61.98 2.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.184 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.9 p -152.96 -169.35 3.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.113 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 415' ' ' ILE . . . . . 0.582 HG21 HG11 ' B' ' 434' ' ' VAL . 48.8 mt -145.2 128.92 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.859 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 416' ' ' GLU . . . . . 0.421 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.8 108.8 18.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.746 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 417' ' ' ILE . . . . . 0.606 HG12 ' HB ' ' B' ' 432' ' ' ILE . 61.1 mt -128.53 108.59 19.03 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.643 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 418' ' ' PRO . . . . . 0.661 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.48 147.56 8.98 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.689 2.259 . . . . 0.0 112.903 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 419' ' ' ARG . . . . . 0.502 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.83 74.74 22.11 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.158 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -47.19 117.1 2.05 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.758 2.305 . . . . 0.0 112.475 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 421' ' ' VAL . . . . . 0.513 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.5 t -74.39 97.81 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.189 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.64 21.73 9.08 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.535 0.683 . . . . 0.0 109.29 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 423' ' ' GLY . . . . . 0.565 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.31 29.29 6.07 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.291 -179.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 424' ' ' VAL . . . . . 0.513 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.45 -37.51 30.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.17 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.85 35.78 4.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.793 0.33 . . . . 0.0 111.771 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 426' ' ' VAL . . . . . 0.651 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.32 -44.69 47.98 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.74 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 427' ' ' PRO . . . . . 0.651 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.9 Cg_endo -66.26 77.05 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.477 2.118 . . . . 0.0 111.102 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.34 -15.43 3.2 Favored Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.339 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.54 149.4 50.19 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.596 0.236 . . . . 0.0 110.729 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.5 -14.24 5.06 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.841 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.41 126.13 44.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.819 0.342 . . . . 0.0 111.024 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 432' ' ' ILE . . . . . 0.661 HG22 ' HD2' ' B' ' 418' ' ' PRO . 7.9 pt -131.04 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.264 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 433' ' ' PHE . . . . . 0.565 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.51 -176.4 2.81 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.981 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 434' ' ' VAL . . . . . 0.582 HG11 HG21 ' B' ' 415' ' ' ILE . 3.3 m -135.73 141.74 41.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.193 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 435' ' ' GLU . . . . . 0.471 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.37 108.48 17.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.778 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.78 168.32 12.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.256 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 437' ' ' THR . . . . . 0.608 HG23 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.91 -45.34 7.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.474 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.91 146.6 52.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.004 0.431 . . . . 0.0 111.215 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.22 -12.78 16.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.215 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.54 -54.79 26.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.086 0.469 . . . . 0.0 110.189 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -75.18 -29.54 60.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.789 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 442' ' ' CYS . . . . . 0.41 ' O ' ' HG2' ' B' ' 446' ' ' MET . 0.3 OUTLIER -62.13 -31.76 72.27 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.185 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.68 -48.08 15.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.611 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.58 -11.99 59.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.776 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.86 -55.9 3.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.939 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 446' ' ' MET . . . . . 0.527 ' O ' HG22 ' B' ' 450' ' ' THR . 1.9 ptp -62.87 -29.17 70.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.142 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -68.41 -16.2 63.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.603 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.63 -8.62 22.52 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.367 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.2 mt -95.69 -19.65 19.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.711 0.291 . . . . 0.0 110.925 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 450' ' ' THR . . . . . 0.527 HG22 ' O ' ' B' ' 446' ' ' MET . 39.9 p -70.02 132.22 45.56 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.087 175.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.31 -9.19 78.08 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.384 176.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -77.14 -152.2 0.04 OUTLIER 'General case' 0 C--O 1.232 0.153 0 CA-C-N 117.322 0.561 . . . . 0.0 110.517 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 453' ' ' LYS . . . . . 0.459 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.85 117.08 2.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.359 . . . . 0.0 111.324 -179.866 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.29 -36.36 75.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.494 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.21 -50.91 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.817 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.22 24.89 0.3 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.783 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 457' ' ' ARG . . . . . 0.403 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.45 136.54 19.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.253 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 8.2 p -56.47 140.17 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.994 176.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 50.7 t -101.73 121.67 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -174.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 460' ' ' VAL . . . . . 0.741 HG22 HG12 ' A' ' 53' ' ' ILE . 33.9 t -83.33 100.41 6.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.121 175.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 461' ' ' THR . . . . . 0.523 HG22 HD21 ' B' ' 380' ' ' LEU . 8.2 p -105.62 111.55 24.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.872 0.368 . . . . 0.0 110.94 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 462' ' ' LYS . . . . . 0.429 ' HB2' ' HE3' ' B' ' 462' ' ' LYS . 31.7 mtmt -117.65 -164.59 1.01 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.28 0.562 . . . . 0.0 111.271 -177.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 463' ' ' TYR . . . . . 0.463 ' CD2' ' HE1' ' B' ' 446' ' ' MET . 1.2 m-85 -111.75 147.07 36.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.549 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 464' ' ' CYS . . . . . 0.442 ' O ' HG21 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.91 148.9 47.29 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.003 0.43 . . . . 0.0 111.373 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 465' ' ' ASP . . . . . 0.449 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.35 129.43 66.41 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.366 -179.858 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 466' ' ' PRO . . . . . 0.473 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.04 -33.4 73.19 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.782 2.321 . . . . 0.0 112.035 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.99 -58.53 7.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.396 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 468' ' ' SER . . . . . 0.461 ' H ' ' HG ' ' B' ' 468' ' ' SER . 0.8 OUTLIER -57.39 -33.76 68.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.26 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 469' ' ' TYR . . . . . 0.471 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.01 -51.27 70.38 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.162 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.39 -47.54 69.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 471' ' ' ARG . . . . . 0.443 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.64 -2.16 49.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.42 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.78 8.74 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.913 0.387 . . . . 0.0 110.223 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 473' ' ' ASP . . . . . 0.466 ' O ' ' HB2' ' B' ' 474' ' ' PHE . 0.3 OUTLIER -56.66 -20.13 19.88 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.981 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 474' ' ' PHE . . . . . 0.466 ' HB2' ' O ' ' B' ' 473' ' ' ASP . 3.3 m-30 . . . . . 0 N--CA 1.471 0.59 0 C-N-CA 123.331 0.652 . . . . 0.0 111.319 -178.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.142 0.02 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.07 115.51 2.55 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.624 2.216 . . . . 0.0 112.378 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.05 -166.77 1.32 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.4 51.93 12.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.894 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.42 -36.19 3.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.952 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.75 91.9 2.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.9 -54.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.832 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.22 13.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.96 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.99 125.56 24.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.713 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.72 19.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.024 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . 0.542 ' HZ3' HG11 ' B' ' 459' ' ' VAL . 71.8 m95 -141.97 53.09 1.48 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.798 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.2 -156.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.858 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.473 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.36 -37.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.71 120.6 40.64 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 118.956 -0.545 . . . . 0.0 110.598 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.0 p . . . . . 0 C--N 1.329 -0.316 0 O-C-N 123.63 0.581 . . . . 0.0 111.238 -178.344 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 mm? . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.723 0.297 . . . . 0.0 111.358 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.504 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.6 p -95.12 156.62 16.24 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.159 175.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.412 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.21 -31.35 71.12 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 120.889 0.376 . . . . 0.0 111.301 -174.663 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.428 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.36 -45.13 61.22 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.23 -33.05 72.69 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.731 -177.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.504 ' HG3' ' O ' ' A' ' 45' ' ' THR . 44.5 mt-10 -60.55 -45.3 94.38 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.221 177.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.407 ' O ' HG23 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.05 -43.34 98.93 Favored 'General case' 0 C--O 1.185 -2.318 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.29 177.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.438 ' HA ' HG23 ' A' ' 54' ' ' VAL . . . -58.33 -40.77 83.01 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 123.771 0.669 . . . . 0.0 111.571 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -67.55 -46.48 72.63 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 122.175 -0.328 . . . . 0.0 110.759 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.718 HG23 HG21 ' B' ' 460' ' ' VAL . 87.2 mt -58.52 -51.16 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 110.751 176.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.438 HG23 ' HA ' ' A' ' 51' ' ' ALA . 35.0 m -66.67 -35.6 75.2 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.744 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.919 -175.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.16 -44.91 92.14 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.537 0.608 . . . . 0.0 110.312 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.465 ' HA ' ' HG2' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -70.15 -28.08 65.06 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.828 179.358 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.48 ' HB3' ' CD1' ' A' ' 112' ' ' LEU . 15.8 mt-30 -74.34 -38.49 63.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.231 174.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.475 HD11 HD11 ' A' ' 113' ' ' ILE . 72.7 mt -62.53 -47.04 94.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 114.871 -1.058 . . . . 0.0 110.374 178.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.465 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.4 -41.51 84.84 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.689 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -67.42 -34.36 77.08 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.257 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.524 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.18 -44.91 78.49 Favored 'General case' 0 C--O 1.207 -1.175 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 174.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 m -65.67 -35.72 81.58 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -178.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.46 ' O ' HG21 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.76 -42.8 75.98 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 122.111 0.958 . . . . 0.0 108.516 176.181 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.524 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.79 -47.73 83.84 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 113.797 -1.547 . . . . 0.0 111.898 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.21 -28.89 63.47 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.812 177.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -68.05 -47.06 69.38 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.46 HG21 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.52 14.45 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.971 -0.692 . . . . 0.0 112.846 -177.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.74 29.44 10.74 Favored Glycine 0 C--N 1.315 -0.592 0 C-N-CA 119.87 -1.157 . . . . 0.0 111.285 -177.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.44 90.05 6.68 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.163 0.506 . . . . 0.0 110.147 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.0 tp . . . . . 0 C--N 1.331 -0.201 0 O-C-N 121.692 -0.63 . . . . 0.0 112.3 -170.832 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.437 -1.097 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -72.12 -52.46 16.64 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.27 -0.894 . . . . 0.0 109.7 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.5 mp0 -53.23 -51.76 61.12 Favored 'General case' 0 CA--C 1.502 -0.889 0 CA-C-N 113.612 -1.631 . . . . 0.0 110.702 -178.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.69 -38.69 87.28 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 113.428 -1.714 . . . . 0.0 110.632 -177.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . 0.509 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.95 -44.5 94.34 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 123.154 0.284 . . . . 0.0 110.369 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.703 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.3 m -68.91 -50.11 52.3 Favored 'General case' 0 N--CA 1.428 -1.538 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.677 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.41 -41.3 93.78 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -175.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.04 -39.17 89.95 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 178.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.521 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.25 -40.11 89.13 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.703 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.3 mt -63.93 -41.04 97.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.679 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.05 -34.4 78.32 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.805 178.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.48 -34.33 74.19 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 177.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.48 -48.83 76.05 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 175.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.535 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.38 -45.48 94.2 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.352 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.3 -37.4 85.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 123.53 0.732 . . . . 0.0 111.027 -178.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.83 -43.72 85.99 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.48 ' CD1' ' HB3' ' A' ' 57' ' ' GLN . 65.7 mt -72.2 -38.63 68.99 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.771 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.535 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.36 -50.86 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 CA-C-O 120.538 0.208 . . . . 0.0 110.552 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.8 m -60.72 -39.53 88.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.289 0.566 . . . . 0.0 110.529 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.594 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.54 61.12 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.024 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.34 -37.15 84.68 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -177.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.8 t -65.58 -36.83 78.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.74 80.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.245 0.545 . . . . 0.0 110.248 177.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.6 mt -71.43 -40.59 70.33 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.055 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -133.62 111.15 12.47 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.011 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.68 -22.72 37.14 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.819 2.346 . . . . 0.0 112.577 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.28 0.04 56.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.137 -177.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.89 134.64 54.44 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.627 -178.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -105.37 109.23 62.97 Favored Pre-proline 0 CA--C 1.51 -0.583 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.211 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.32 157.88 59.94 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.293 1.995 . . . . 0.0 111.553 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.63 154.51 25.14 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 123.603 2.869 . . . . 0.0 111.711 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.03 -28.46 67.41 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -173.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -73.6 -8.62 56.71 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.728 0.642 . . . . 0.0 111.868 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 87.3 t80 . . . . . 0 C--O 1.232 0.153 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 176.77 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo . . . . . 0 CA--C 1.532 0.39 0 N-CA-C 113.662 0.601 . . . . 0.0 113.662 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 375' ' ' THR . . . . . 0.452 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -117.78 -71.32 0.74 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.168 174.196 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 376' ' ' GLU . . . . . 0.475 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.88 0.01 OUTLIER 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.071 0.396 . . . . 0.0 112.071 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 377' ' ' VAL . . . . . 0.453 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.64 150.97 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.112 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.448 -179.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 378' ' ' LEU . . . . . 0.459 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.65 152.51 20.83 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.179 -179.052 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 379' ' ' CYS . . . . . 0.567 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.49 142.5 46.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.636 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . 0.433 HD11 HG11 ' B' ' 434' ' ' VAL . 5.3 mt -132.73 101.64 5.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.897 0.379 . . . . 0.0 111.046 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 381' ' ' MET . . . . . 0.478 ' O ' HG23 ' B' ' 459' ' ' VAL . 27.0 ttp -117.97 165.13 14.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.604 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 382' ' ' ASN . . . . . 0.452 HD22 HE21 ' A' ' 57' ' ' GLN . 13.4 t30 58.85 51.19 7.69 Favored 'General case' 0 C--N 1.34 0.158 0 O-C-N 123.508 0.505 . . . . 0.0 111.387 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 383' ' ' MET . . . . . 0.412 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.85 14.38 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.228 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 384' ' ' VAL . . . . . 0.494 HG21 HG21 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.29 125.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.885 0.374 . . . . 0.0 111.315 179.878 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.76 151.72 43.05 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.402 179.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.15 -23.44 73.11 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.317 2.011 . . . . 0.0 112.297 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.91 -5.49 53.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.52 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.03 -36.77 5.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.911 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 389' ' ' LEU . . . . . 0.465 HD13 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.94 34.92 0.46 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.984 0.421 . . . . 0.0 110.684 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 390' ' ' LEU . . . . . 0.524 HD21 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.51 -15.7 5.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.695 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.41 148.72 23.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.521 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -73.52 -30.28 63.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.176 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.28 -47.73 26.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.69 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.58 -44.3 91.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.71 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.33 -59.39 5.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.184 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.26 61.56 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.202 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.2 -41.05 67.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.39 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 398' ' ' ILE . . . . . 0.48 HD13 HG13 ' B' ' 384' ' ' VAL . 65.4 mt -74.91 -53.65 16.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.5 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 399' ' ' VAL . . . . . 0.578 HG22 HD13 ' B' ' 417' ' ' ILE . 59.8 t -53.28 -46.96 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.805 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.46 -59.97 3.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.517 -179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.64 -57.18 11.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.356 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.12 -32.83 15.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.361 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 403' ' ' ARG . . . . . 0.431 ' HA ' HD13 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.22 -57.38 4.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.165 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.91 -33.64 64.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.198 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 405' ' ' GLU . . . . . 0.527 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.46 -47.03 44.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.963 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.84 -24.0 67.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.154 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.04 30.34 1.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.957 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.07 -17.16 12.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.93 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.72 -15.39 14.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.503 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.13 -139.43 4.16 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.574 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.26 132.46 56.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.726 0.298 . . . . 0.0 111.079 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.38 115.46 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.052 0.453 . . . . 0.0 110.6 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . 0.605 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.62 -62.04 2.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.136 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.98 -169.36 3.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.147 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 415' ' ' ILE . . . . . 0.624 HG23 HG12 ' B' ' 434' ' ' VAL . 48.2 mt -145.1 128.97 12.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.876 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 416' ' ' GLU . . . . . 0.42 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.88 108.83 18.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.674 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 417' ' ' ILE . . . . . 0.609 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.5 mt -128.58 108.5 18.94 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.663 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 418' ' ' PRO . . . . . 0.668 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.47 147.62 8.9 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.621 2.214 . . . . 0.0 112.886 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 419' ' ' ARG . . . . . 0.524 HH21 HD21 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.91 74.74 21.82 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.141 179.841 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -47.17 117.08 2.03 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.729 2.286 . . . . 0.0 112.497 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 421' ' ' VAL . . . . . 0.521 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.0 t -74.44 97.86 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.128 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.59 21.77 9.04 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.559 0.695 . . . . 0.0 109.358 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 423' ' ' GLY . . . . . 0.54 ' HA2' HG21 ' B' ' 426' ' ' VAL . . . 102.25 29.31 6.09 Favored Glycine 0 N--CA 1.444 -0.819 0 CA-C-N 114.79 -1.096 . . . . 0.0 111.306 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 424' ' ' VAL . . . . . 0.521 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.51 -37.5 30.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.152 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.92 35.93 4.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.777 0.323 . . . . 0.0 111.741 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 426' ' ' VAL . . . . . 0.646 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.37 -44.68 47.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.759 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 427' ' ' PRO . . . . . 0.646 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.34 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.488 2.125 . . . . 0.0 111.05 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.3 -15.37 3.22 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.341 -178.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.54 149.31 50.31 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.649 0.261 . . . . 0.0 110.743 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.61 -14.31 5.03 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.838 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 126.06 44.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.839 0.352 . . . . 0.0 111.111 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 432' ' ' ILE . . . . . 0.668 HG22 ' HD2' ' B' ' 418' ' ' PRO . 7.8 pt -130.96 172.91 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.252 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 433' ' ' PHE . . . . . 0.567 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.37 2.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.986 0.422 . . . . 0.0 111.966 -178.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 434' ' ' VAL . . . . . 0.624 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.79 141.72 41.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.179 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 435' ' ' GLU . . . . . 0.479 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.39 108.47 17.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.836 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.74 168.35 12.56 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.205 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 437' ' ' THR . . . . . 0.605 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.96 -45.36 7.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.458 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.93 146.54 52.16 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.041 0.448 . . . . 0.0 111.25 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.14 -12.8 16.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.26 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -54.89 25.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.141 0.496 . . . . 0.0 110.121 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -75.06 -29.53 60.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.858 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -31.79 72.35 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.094 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.63 -48.08 15.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.611 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.54 -12.1 59.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.753 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -55.69 3.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.96 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 446' ' ' MET . . . . . 0.572 ' O ' HG22 ' B' ' 450' ' ' THR . 3.6 ptm -63.74 -28.15 69.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.038 -179.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.06 -16.28 63.66 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.54 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.56 -8.62 22.64 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.487 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.3 mt -95.73 -19.87 19.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.739 0.304 . . . . 0.0 110.909 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 450' ' ' THR . . . . . 0.572 HG22 ' O ' ' B' ' 446' ' ' MET . 43.2 p -70.02 131.74 44.83 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.884 175.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.81 -9.46 76.74 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.531 177.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -77.15 -152.16 0.04 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 117.252 0.526 . . . . 0.0 110.505 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 453' ' ' LYS . . . . . 0.473 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.84 117.01 2.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.855 0.359 . . . . 0.0 111.34 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.17 -36.41 75.26 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.538 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.817 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.32 24.84 0.3 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.817 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 457' ' ' ARG . . . . . 0.412 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.46 134.58 18.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.294 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 6.6 p -66.3 129.69 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.871 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 459' ' ' VAL . . . . . 0.542 HG11 ' HZ3' ' A' ' 22' ' ' TRP . 2.0 p -94.48 122.98 46.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.521 -175.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 460' ' ' VAL . . . . . 0.718 HG21 HG23 ' A' ' 53' ' ' ILE . 41.2 t -92.53 92.91 3.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.35 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 76.7 p -83.32 142.67 30.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.301 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 462' ' ' LYS . . . . . 0.442 ' HA ' ' HE3' ' B' ' 446' ' ' MET . 1.3 ttmm -139.01 -164.18 1.61 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.2 0.524 . . . . 0.0 111.337 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.73 146.95 37.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.512 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 464' ' ' CYS . . . . . 0.453 ' O ' HG21 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 148.99 47.45 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.999 0.428 . . . . 0.0 111.456 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 465' ' ' ASP . . . . . 0.452 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.35 129.39 66.6 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.337 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 466' ' ' PRO . . . . . 0.475 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.12 -33.22 73.26 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.655 2.236 . . . . 0.0 112.103 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.07 -58.39 8.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.453 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.51 -33.74 68.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.233 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 469' ' ' TYR . . . . . 0.479 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.07 -51.19 70.69 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.209 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.4 -47.49 69.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.332 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 471' ' ' ARG . . . . . 0.448 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.73 -2.11 49.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.399 -179.886 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.07 20.78 8.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.905 0.383 . . . . 0.0 110.285 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 473' ' ' ASP . . . . . 0.51 ' O ' ' HB2' ' B' ' 474' ' ' PHE . 0.3 OUTLIER -56.75 -20.48 22.39 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.959 179.927 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 474' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' B' ' 473' ' ' ASP . 2.8 m-30 . . . . . 0 N--CA 1.472 0.654 0 C-N-CA 123.967 0.907 . . . . 0.0 111.582 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.2 ttm . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.724 0.297 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.99 -69.2 0.66 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.546 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -125.58 -90.18 0.55 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.748 0.308 . . . . 0.0 111.699 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -112.06 165.33 12.08 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.41 -178.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -119.12 141.76 48.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.92 0.391 . . . . 0.0 111.299 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -93.12 -48.64 6.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.92 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 64.56 -176.21 0.17 Allowed 'General case' 0 N--CA 1.468 0.458 0 O-C-N 123.737 0.648 . . . . 0.0 111.938 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.8 p -127.36 145.01 52.83 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.059 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.66 132.61 41.12 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.801 2.334 . . . . 0.0 111.998 176.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 98.4 mt -73.29 107.7 5.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.435 -178.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -160.44 108.1 1.6 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.661 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -84.86 141.58 38.27 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.154 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -56.66 115.57 2.57 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.998 2.465 . . . . 0.0 112.34 -177.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.73 1.32 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.833 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.88 12.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.38 -36.22 3.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.984 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.74 91.89 2.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.894 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.89 -54.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.838 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.85 111.21 13.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.973 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.02 125.58 24.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.755 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.76 19.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.009 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.515 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.9 m95 -141.97 53.02 1.48 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.782 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.23 -156.57 0.13 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.879 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.465 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.27 -37.72 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.87 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.76 122.69 47.17 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.593 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.405 ' C ' ' H ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -129.33 168.18 16.64 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 124.03 0.831 . . . . 0.0 110.399 176.135 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.7 tpt 74.35 -24.08 0.22 Allowed 'General case' 0 N--CA 1.473 0.708 0 O-C-N 123.736 0.648 . . . . 0.0 112.268 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.405 ' H ' ' C ' ' A' ' 26' ' ' THR . 11.6 pt-20 -145.93 -173.08 4.06 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.671 0.272 . . . . 0.0 110.898 -178.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -78.46 143.6 36.54 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.601 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -66.11 109.03 2.44 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.609 -177.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.8 t -157.61 -27.63 0.08 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.735 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 22.0 t -85.53 103.82 12.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.297 177.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.461 ' H ' HG13 ' A' ' 33' ' ' ILE . 1.0 OUTLIER -102.5 117.79 60.16 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -173.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 33' ' ' ILE . 4.7 Cg_exo -77.63 118.52 4.56 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.111 2.541 . . . . 0.0 111.489 173.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -112.57 88.71 0.5 Allowed Glycine 0 CA--C 1.517 0.215 0 C-N-CA 120.464 -0.874 . . . . 0.0 113.15 -176.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.4 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 13.5 tpt -163.12 121.86 1.32 Allowed Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 116.518 0.159 . . . . 0.0 110.836 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 36' ' ' MET . 30.2 Cg_exo -62.58 149.02 92.45 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.858 2.372 . . . . 0.0 112.277 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.597 ' HB ' ' HA ' ' B' ' 460' ' ' VAL . 52.6 p -107.89 -26.22 10.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.661 -175.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.523 HG13 ' HE1' ' B' ' 446' ' ' MET . 32.9 m -55.73 139.43 14.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.004 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.794 ' H ' ' HG3' ' B' ' 462' ' ' LYS . 0.1 OUTLIER -99.11 133.26 22.28 Favored Pre-proline 0 CA--C 1.533 0.307 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.36 -178.05 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 40' ' ' ILE . 14.8 Cg_exo -68.65 152.05 74.63 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 123.586 2.857 . . . . 0.0 112.847 -176.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -80.47 105.58 1.75 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.652 2.234 . . . . 0.0 112.803 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 137.36 41.34 0.1 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.262 177.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -127.86 -170.64 2.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.219 0.533 . . . . 0.0 111.475 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.461 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 71.5 p -119.1 162.3 18.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.159 176.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.404 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.72 -31.42 72.34 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 120.896 0.379 . . . . 0.0 111.334 -178.239 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.461 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.3 -45.21 61.01 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.08 -33.45 73.55 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.749 -177.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.549 ' HG3' HD12 ' A' ' 40' ' ' ILE . 39.6 tt0 -59.22 -46.32 88.77 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.998 177.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -63.18 -43.36 98.44 Favored 'General case' 0 C--O 1.185 -2.316 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.229 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.427 ' HA ' HG23 ' A' ' 54' ' ' VAL . . . -58.39 -41.41 84.81 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.765 0.666 . . . . 0.0 111.602 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -66.99 -42.79 84.44 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.024 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.689 HG23 HG23 ' B' ' 460' ' ' VAL . 96.6 mt -66.25 -49.14 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.768 177.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.427 HG23 ' HA ' ' A' ' 51' ' ' ALA . 35.0 m -65.57 -35.65 75.75 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.931 -176.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.11 -44.39 91.99 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.491 0.587 . . . . 0.0 110.372 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.3 tp -62.67 -42.01 99.39 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.807 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.521 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 43.0 mt-30 -68.78 -35.67 77.34 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.641 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 54' ' ' VAL . 73.3 mt -62.83 -47.0 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.431 178.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.35 -41.81 84.52 Favored 'General case' 0 CA--C 1.513 -0.47 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.701 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.26 -33.15 73.83 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.441 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.526 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.1 -44.94 78.72 Favored 'General case' 0 C--O 1.207 -1.159 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 173.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.0 m -65.55 -35.79 81.88 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.469 ' O ' HG21 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.72 -42.83 75.89 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 122.089 0.947 . . . . 0.0 108.531 176.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.526 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.2 ttmt -61.75 -47.75 83.8 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 113.773 -1.558 . . . . 0.0 111.921 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.17 -28.89 63.51 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.788 -0.765 . . . . 0.0 111.863 177.01 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.95 -47.16 69.41 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.469 HG21 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.1 -17.52 14.46 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.966 -0.694 . . . . 0.0 112.853 -177.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.45 10.76 Favored Glycine 0 C--N 1.316 -0.53 0 C-N-CA 119.857 -1.163 . . . . 0.0 111.268 -177.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.43 91.37 6.84 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.233 0.539 . . . . 0.0 110.171 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.4 tp -101.8 -51.68 3.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 178.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.15 -94.19 1.67 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.486 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.489 HD11 HD21 ' B' ' 456' ' ' ASN . 25.2 pt -104.15 144.67 29.17 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.568 0.223 . . . . 0.0 110.953 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 72' ' ' ILE . 16.0 Cg_exo -68.46 146.35 67.98 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.693 2.262 . . . . 0.0 112.069 178.066 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.59 -45.57 32.92 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.863 2.375 . . . . 0.0 111.958 178.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.407 ' HA ' ' HD2' ' A' ' 76' ' ' PRO . 5.5 m-20 -123.9 96.61 42.45 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.646 176.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 75' ' ' ASN . 21.0 Cg_endo -60.82 -54.54 1.88 Allowed 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.822 2.348 . . . . 0.0 111.802 176.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -104.66 102.81 12.39 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.455 173.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -66.28 146.6 54.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.325 0.584 . . . . 0.0 111.455 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 79' ' ' ARG . 62.3 mtt-85 -81.43 -157.28 0.17 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.584 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 42.2 t -65.4 128.5 93.85 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.181 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.66 129.35 31.98 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.977 2.451 . . . . 0.0 112.777 -177.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 36.0 t -143.48 136.72 13.97 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.884 -176.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -73.46 -177.62 3.16 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 123.121 2.547 . . . . 0.0 113.055 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 85' ' ' PRO . 8.4 pt-20 -89.12 141.4 29.29 Favored Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.497 -178.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 84' ' ' GLU . 11.6 Cg_exo -70.9 -30.75 16.52 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.208 2.606 . . . . 0.0 112.075 176.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 6.2 tp -80.15 137.78 20.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.867 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -85.87 117.53 24.79 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.842 178.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -118.81 129.76 55.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.948 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.9 m -72.54 -52.08 17.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.622 -176.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -160.58 151.99 19.38 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.101 0.477 . . . . 0.0 111.375 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -118.79 179.2 16.83 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.419 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 95' ' ' ASN . 33.6 mmtp -86.01 155.15 20.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.676 0.275 . . . . 0.0 110.807 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.8 tpp180 -89.13 -28.56 19.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.49 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.93 -34.87 17.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.65 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.463 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 2.7 t-20 -117.94 120.66 38.53 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.089 -177.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -163.01 -50.15 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.772 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.1 -52.58 16.12 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.257 -0.902 . . . . 0.0 109.661 -178.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.5 mp0 -53.23 -51.77 61.1 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.623 -1.626 . . . . 0.0 110.667 -178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -66.68 -38.68 87.29 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 113.466 -1.697 . . . . 0.0 110.659 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.516 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.9 -44.54 94.19 Favored 'General case' 0 CA--C 1.511 -0.538 0 O-C-N 123.22 0.325 . . . . 0.0 110.402 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.702 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.4 m -68.95 -50.07 52.42 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.703 178.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.34 -41.37 93.99 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.99 -39.15 90.08 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 100' ' ' ARG . 6.2 tmtt? -60.19 -40.11 88.9 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.98 -41.05 97.64 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.657 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.02 -34.33 78.18 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.824 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.37 74.3 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 177.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.43 -48.86 76.03 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 175.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.536 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.29 -45.53 94.09 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.405 179.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.21 -37.42 85.28 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.564 0.746 . . . . 0.0 111.044 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.84 -43.75 86.07 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.411 HD12 ' HB2' ' A' ' 57' ' ' GLN . 65.6 mt -72.22 -38.58 68.96 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.768 177.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.47 -50.87 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 110.489 -0.189 . . . . 0.0 110.489 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.7 m -60.68 -39.5 88.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.277 0.561 . . . . 0.0 110.557 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.597 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.94 -49.6 60.86 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.005 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.37 -37.12 84.57 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.8 t -65.53 -36.81 78.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.17 0.509 . . . . 0.0 109.644 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.73 80.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.23 0.538 . . . . 0.0 110.25 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.6 mt -71.45 -40.61 70.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.023 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.63 111.2 12.47 Favored Pre-proline 0 C--N 1.317 -0.826 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.936 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.74 -22.66 36.88 Favored 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 122.8 2.334 . . . . 0.0 112.57 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.34 0.13 55.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.101 -177.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.97 134.68 54.44 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.616 -178.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.41 109.11 62.83 Favored Pre-proline 0 CA--C 1.509 -0.614 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.274 177.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.24 157.89 59.85 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 122.303 2.002 . . . . 0.0 111.485 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.55 154.51 24.73 Favored 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 123.603 2.868 . . . . 0.0 111.777 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.06 -32.41 72.74 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 -173.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -73.82 -24.92 59.86 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 123.895 0.747 . . . . 0.0 110.951 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -68.85 122.93 19.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.295 175.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -111.57 139.49 22.15 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.772 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.51 136.2 49.34 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.548 2.165 . . . . 0.0 111.612 175.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -60.34 169.21 5.39 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.041 2.494 . . . . 0.0 112.99 -178.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . 70.07 113.32 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.659 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 64.9 p -78.45 -25.86 46.01 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.41 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 21.2 mmm180 70.44 160.2 0.21 Allowed 'General case' 0 N--CA 1.472 0.653 0 O-C-N 123.764 0.665 . . . . 0.0 112.181 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 16.8 m -114.54 169.76 5.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.338 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 85.6 m 65.52 -173.08 0.18 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.788 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -122.54 123.66 41.75 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.073 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.437 ' HB3' ' H ' ' A' ' 140' ' ' VAL . 9.2 mmmm 63.53 -163.04 0.27 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.75 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . 0.437 ' H ' ' HB3' ' A' ' 139' ' ' LYS . 2.2 t -107.14 148.12 11.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.075 -177.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 4.6 ptt? -87.13 172.11 10.19 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.603 176.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 5.0 mt -112.12 116.33 49.33 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.778 -175.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -76.08 131.82 13.44 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.4 2.067 . . . . 0.0 111.804 173.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -103.56 149.66 24.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.103 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 26.4 t70 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.169 -0.92 . . . . 0.0 110.642 179.774 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 112.421 -0.272 . . . . 0.0 112.421 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 373' ' ' HIS . . . . . 0.521 ' H ' ' HD2' ' B' ' 374' ' ' PRO . 24.7 t60 -129.85 -47.19 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.484 0 CA-C-O 119.177 -0.44 . . . . 0.0 111.966 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 374' ' ' PRO . . . . . 0.521 ' HD2' ' H ' ' B' ' 373' ' ' HIS . 80.8 Cg_exo -50.62 129.04 25.59 Favored 'Trans proline' 0 C--N 1.364 1.356 0 C-N-CA 122.363 2.042 . . . . 0.0 113.358 178.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 375' ' ' THR . . . . . 0.448 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -117.77 -71.38 0.74 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.119 179.892 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 376' ' ' GLU . . . . . 0.484 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.91 0.01 OUTLIER 'General case' 0 C--O 1.232 0.136 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 377' ' ' VAL . . . . . 0.45 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.66 150.97 7.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.431 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 378' ' ' LEU . . . . . 0.456 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.59 152.51 20.86 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.246 -179.086 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 379' ' ' CYS . . . . . 0.56 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.55 142.61 46.49 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.567 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . 0.414 ' HB3' ' SD ' ' B' ' 383' ' ' MET . 5.4 mt -132.79 103.13 5.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.968 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 381' ' ' MET . . . . . 0.507 ' HE3' ' HE2' ' B' ' 431' ' ' LYS . 10.3 ttt -116.86 162.79 17.17 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.194 -176.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.58 51.25 8.09 Favored 'General case' 0 C--N 1.342 0.262 0 O-C-N 123.208 0.318 . . . . 0.0 111.275 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 383' ' ' MET . . . . . 0.414 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.92 14.39 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.259 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 384' ' ' VAL . . . . . 0.484 HG12 HD11 ' B' ' 398' ' ' ILE . 0.4 OUTLIER -152.3 125.11 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.83 0.347 . . . . 0.0 111.354 179.863 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . . . . . . . . . 20.1 mt -110.69 151.77 43.04 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.428 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.12 -23.53 73.29 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.307 2.005 . . . . 0.0 112.315 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.85 -5.48 53.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.559 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.07 -36.7 5.78 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.901 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 389' ' ' LEU . . . . . 0.459 HD12 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.91 0.46 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 390' ' ' LEU . . . . . 0.521 HD21 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.53 -15.73 5.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.663 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -98.28 148.77 23.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.574 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -73.52 -30.26 62.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.21 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -75.37 -47.65 26.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.728 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.57 -44.27 91.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.768 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -56.4 -59.34 5.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.249 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.3 61.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.194 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.1 -41.04 67.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.412 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 398' ' ' ILE . . . . . 0.484 HD11 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.89 -53.67 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.517 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 399' ' ' VAL . . . . . 0.58 HG22 HD11 ' B' ' 417' ' ' ILE . 59.6 t -53.34 -46.91 58.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.814 -179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.99 3.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.486 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.63 -57.13 11.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.389 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.15 -32.9 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.33 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 403' ' ' ARG . . . . . 0.442 ' HA ' HD13 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.2 -57.41 4.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.706 0.288 . . . . 0.0 111.116 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.98 -33.57 64.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.162 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 405' ' ' GLU . . . . . 0.515 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.5 -47.04 44.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.942 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.89 -23.88 67.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.144 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.12 30.38 1.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.961 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.13 -17.17 12.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.863 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.41 14.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.574 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.14 -139.4 4.14 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.586 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 411' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.22 132.4 56.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.678 0.275 . . . . 0.0 111.101 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.36 115.43 48.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.01 0.433 . . . . 0.0 110.692 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . 0.605 ' HG3' HG21 ' B' ' 437' ' ' THR . 10.9 mttt -56.63 -61.95 2.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.186 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.02 -169.4 3.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.088 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 415' ' ' ILE . . . . . 0.577 HG21 HG13 ' B' ' 434' ' ' VAL . 48.7 mt -145.12 128.98 12.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.833 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 416' ' ' GLU . . . . . 0.416 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.87 108.8 18.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.667 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 417' ' ' ILE . . . . . 0.607 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.9 mt -128.56 108.6 18.99 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.625 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 418' ' ' PRO . . . . . 0.669 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.6 Cg_endo -48.56 147.65 9.11 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.667 2.245 . . . . 0.0 112.866 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 419' ' ' ARG . . . . . 0.521 HH21 HD21 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.93 74.73 21.73 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.149 179.854 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -47.15 117.05 2.0 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.728 2.285 . . . . 0.0 112.491 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 421' ' ' VAL . . . . . 0.517 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.2 t -74.36 97.77 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.186 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.65 21.77 9.14 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.479 0.657 . . . . 0.0 109.32 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 423' ' ' GLY . . . . . 0.549 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.26 29.26 6.1 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.328 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 424' ' ' VAL . . . . . 0.517 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.51 -37.45 30.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.94 35.9 4.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 111.776 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 426' ' ' VAL . . . . . 0.659 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.33 -44.74 48.12 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.783 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 427' ' ' PRO . . . . . 0.659 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.29 77.08 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.497 2.131 . . . . 0.0 111.095 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.3 -15.39 3.22 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.359 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.3 t -67.54 149.38 50.22 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.573 0.225 . . . . 0.0 110.82 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.51 -14.2 5.06 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.814 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 431' ' ' LYS . . . . . 0.507 ' HE2' ' HE3' ' B' ' 381' ' ' MET . 0.0 OUTLIER -125.43 126.13 44.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.871 0.367 . . . . 0.0 111.092 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 432' ' ' ILE . . . . . 0.669 HG22 ' HD2' ' B' ' 418' ' ' PRO . 7.8 pt -131.05 172.87 15.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.232 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 433' ' ' PHE . . . . . 0.56 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.33 2.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.958 0.409 . . . . 0.0 112.015 -178.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 434' ' ' VAL . . . . . 0.577 HG13 HG21 ' B' ' 415' ' ' ILE . 3.3 m -135.86 141.68 41.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.18 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 435' ' ' GLU . . . . . 0.48 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.31 108.48 17.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.841 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.7 168.42 12.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.234 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 437' ' ' THR . . . . . 0.605 HG21 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -95.02 -45.34 7.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.439 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.94 146.62 52.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 111.198 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.26 -12.7 16.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.248 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.9 24.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.098 0.475 . . . . 0.0 110.078 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -75.07 -29.52 60.71 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.842 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.16 -31.74 72.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.209 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.72 -47.99 15.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.622 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.1 59.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.709 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.79 -55.76 3.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 446' ' ' MET . . . . . 0.523 ' HE1' HG13 ' A' ' 39' ' ' VAL . 4.2 ptm -63.64 -27.7 69.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.297 -179.753 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.51 -16.26 63.41 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.632 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.65 -8.58 22.52 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.374 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.2 mt -95.71 -19.02 20.02 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.813 0.34 . . . . 0.0 110.969 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 3.6 t -74.37 131.1 40.82 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.989 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.53 -9.65 73.73 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.23 178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -76.41 -152.23 0.04 OUTLIER 'General case' 0 C--N 1.339 0.133 0 CA-C-N 117.327 0.564 . . . . 0.0 110.495 178.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 453' ' ' LYS . . . . . 0.465 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.79 117.12 2.29 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.811 0.338 . . . . 0.0 111.292 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.2 -36.4 75.29 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.545 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.824 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 456' ' ' ASN . . . . . 0.489 HD21 HD11 ' A' ' 72' ' ' ILE . 6.4 p30 -157.29 24.93 0.3 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.771 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 457' ' ' ARG . . . . . 0.409 ' NE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.5 135.3 18.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.279 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 46.3 t -63.38 122.44 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.42 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 59.4 t -76.62 121.28 28.49 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.714 -177.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 460' ' ' VAL . . . . . 0.689 HG23 HG23 ' A' ' 53' ' ' ILE . 65.5 t -89.79 96.94 6.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.364 176.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 461' ' ' THR . . . . . 0.496 ' H ' ' HG1' ' A' ' 38' ' ' THR . 10.3 t -91.04 153.54 20.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.661 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 462' ' ' LYS . . . . . 0.794 ' HG3' ' H ' ' A' ' 40' ' ' ILE . 2.0 ttpp -159.18 -167.52 2.09 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 121.106 0.479 . . . . 0.0 110.76 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -114.21 146.99 39.65 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 123.385 0.674 . . . . 0.0 110.452 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 464' ' ' CYS . . . . . 0.45 ' O ' HG21 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.91 149.02 47.36 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.104 0.478 . . . . 0.0 111.286 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 465' ' ' ASP . . . . . 0.448 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.39 129.34 66.67 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.372 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 466' ' ' PRO . . . . . 0.484 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.04 -33.32 72.84 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.75 2.3 . . . . 0.0 112.097 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.97 -58.52 7.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.441 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.36 -33.78 68.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.336 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 469' ' ' TYR . . . . . 0.48 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.0 -51.27 70.39 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.21 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.36 -47.51 69.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.367 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 471' ' ' ARG . . . . . 0.451 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.13 49.35 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.44 -179.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.73 8.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.942 0.401 . . . . 0.0 110.269 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 473' ' ' ASP . . . . . 0.451 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.81 -20.54 23.17 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.006 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 63.0 48.39 3.87 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 122.92 0.488 . . . . 0.0 112.017 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 50.7 m95 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.519 -0.753 . . . . 0.0 111.38 179.648 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.3 mtt . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 120.836 0.351 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.77 128.37 34.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.25 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 8.0 t -86.61 -17.5 33.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.67 177.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -179.04 165.85 35.04 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.946 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.28 76.11 8.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.08 0.467 . . . . 0.0 110.974 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -110.46 -38.16 5.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.742 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.73 -46.41 68.96 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.467 177.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.4 p -96.94 119.53 63.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.27 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.49 127.12 21.79 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.729 2.286 . . . . 0.0 112.93 -177.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 mm? 60.0 -98.82 0.09 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.426 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -128.02 -158.47 0.88 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.924 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -68.77 140.48 91.74 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.235 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -56.38 115.48 2.5 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 123.1 2.533 . . . . 0.0 112.458 -174.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.71 1.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.846 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.38 51.93 12.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.913 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.37 -36.24 3.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.992 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.71 91.86 2.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.86 -54.26 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.83 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.79 111.2 13.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.039 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.05 125.6 25.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.693 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 21' ' ' ARG . 0.9 OUTLIER -112.58 12.75 19.92 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.01 -179.805 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.522 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.9 m95 -141.98 53.11 1.48 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.731 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -156.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.84 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.472 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.37 -37.6 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.91 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.65 113.49 24.41 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.246 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.806 HG21 ' H ' ' A' ' 27' ' ' MET . 1.8 t 174.7 -93.38 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -175.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.806 ' H ' HG21 ' A' ' 26' ' ' THR . 3.0 mtm -68.66 -46.74 68.31 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 120.653 0.263 . . . . 0.0 110.325 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 64.82 93.04 0.07 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.377 175.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -133.66 -69.51 0.54 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.133 176.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.421 ' HE2' ' NE2' ' A' ' 57' ' ' GLN . 47.4 mtpt -101.27 91.49 4.53 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 175.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.2 p -89.41 154.53 19.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.932 -0.577 . . . . 0.0 112.55 -173.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.812 HG13 ' HA2' ' B' ' 451' ' ' GLY . 4.9 p -128.73 145.51 35.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.953 170.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.454 HG12 ' HD2' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -95.07 130.32 33.0 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 177.315 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.454 ' HD2' HG12 ' A' ' 33' ' ' ILE . 11.2 Cg_endo -55.07 118.96 5.74 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.056 2.504 . . . . 0.0 112.742 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.82 -27.75 4.55 Favored Glycine 0 N--CA 1.453 -0.216 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.976 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 25.0 mmt -99.48 123.24 48.9 Favored Pre-proline 0 C--N 1.332 -0.188 0 CA-C-O 120.653 0.263 . . . . 0.0 110.554 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.558 ' HB2' HG23 ' A' ' 39' ' ' VAL . 60.5 Cg_endo -72.93 156.23 52.56 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.705 2.27 . . . . 0.0 113.231 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 1.004 ' HB ' HG12 ' B' ' 460' ' ' VAL . 34.9 p -115.42 9.24 15.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.38 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.663 HG11 ' HE3' ' B' ' 446' ' ' MET . 15.4 m -69.91 136.3 26.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.131 179.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.986 ' HB ' ' HD2' ' B' ' 462' ' ' LYS . 57.1 mt -105.12 119.61 52.54 Favored Pre-proline 0 C--N 1.331 -0.211 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 178.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.55 ' HG2' HD22 ' A' ' 44' ' ' LEU . 12.4 Cg_endo -55.06 156.3 16.41 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.311 2.674 . . . . 0.0 113.025 -178.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 6.9 Cg_endo -82.31 107.84 1.69 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.949 2.433 . . . . 0.0 112.591 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 135.71 29.95 0.35 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.795 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.55 HD22 ' HG2' ' A' ' 41' ' ' PRO . 4.3 mm? -111.19 139.17 46.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.655 0.264 . . . . 0.0 111.593 -173.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 48.5 p -77.56 157.92 30.1 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 173.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.621 ' HB2' ' HZ3' ' B' ' 431' ' ' LYS . 0.0 OUTLIER -63.36 -31.32 72.44 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 120.856 0.36 . . . . 0.0 111.319 -173.511 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -72.38 -45.04 61.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.3 -32.83 72.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.735 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' A' ' 46' ' ' ARG . 20.2 pt-20 -66.84 -38.3 86.13 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.028 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.447 ' O ' HG21 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.99 -43.34 96.01 Favored 'General case' 0 C--O 1.185 -2.338 0 CA-C-O 118.877 -0.583 . . . . 0.0 110.25 174.443 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.447 ' HA ' HG21 ' A' ' 54' ' ' VAL . . . -58.43 -41.95 86.21 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 123.794 0.684 . . . . 0.0 111.597 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -64.21 -48.12 77.08 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.834 175.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.695 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 63.5 mt -60.61 -51.8 68.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 120.872 0.368 . . . . 0.0 110.802 177.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.447 HG21 ' HA ' ' A' ' 51' ' ' ALA . 35.0 m -64.77 -35.62 75.48 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.789 0 CA-C-O 118.67 -0.681 . . . . 0.0 111.919 -174.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.01 -44.31 91.66 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.566 0.621 . . . . 0.0 110.317 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 2.2 pp -71.35 -28.19 63.89 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.884 179.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.599 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 14.2 mm-40 -74.51 -36.25 63.22 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 174.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.473 HD11 HD13 ' A' ' 113' ' ' ILE . 72.9 mt -63.21 -46.97 94.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.404 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.503 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.49 -40.86 85.22 Favored 'General case' 0 CA--C 1.513 -0.476 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.7 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.492 ' OD2' ' HA ' ' A' ' 32' ' ' VAL . 84.5 m-20 -71.67 -30.25 65.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.321 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.51 -44.93 77.22 Favored 'General case' 0 C--O 1.208 -1.131 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 171.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.62 -35.79 81.82 Favored 'General case' 0 N--CA 1.432 -1.343 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.48 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.84 -42.7 76.16 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 176.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.81 -47.82 83.38 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 113.856 -1.52 . . . . 0.0 111.848 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.12 -28.91 63.58 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.883 177.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -67.98 -47.14 69.38 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.1 -17.49 14.47 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.916 0.709 . . . . 0.0 112.916 -177.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.47 10.73 Favored Glycine 0 C--N 1.316 -0.565 0 C-N-CA 119.884 -1.151 . . . . 0.0 111.29 -177.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.39 91.42 6.83 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.229 0.538 . . . . 0.0 110.24 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.85 12.84 17.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.626 177.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 142.29 -6.77 2.26 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.031 -177.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.468 ' HB ' ' HD2' ' A' ' 73' ' ' PRO . 39.1 pt -98.08 160.38 28.5 Favored Pre-proline 0 C--N 1.331 -0.221 0 C-N-CA 122.169 0.188 . . . . 0.0 110.939 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.468 ' HD2' ' HB ' ' A' ' 72' ' ' ILE . 24.2 Cg_endo -63.38 131.56 32.48 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.627 2.218 . . . . 0.0 112.358 177.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.78 141.37 96.69 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.27 2.647 . . . . 0.0 112.899 -178.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.8 m120 58.65 71.38 1.0 Allowed Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.148 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -81.59 -15.25 9.86 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.413 2.075 . . . . 0.0 112.15 176.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.61 170.92 15.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.695 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -160.11 -44.03 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.93 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -94.58 96.67 9.6 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.887 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.5 m -150.14 107.35 3.19 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.223 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -72.37 133.86 21.65 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.866 2.377 . . . . 0.0 111.932 176.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.6 p -115.0 115.14 43.42 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.874 0.369 . . . . 0.0 111.842 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -75.72 134.09 16.26 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.174 2.583 . . . . 0.0 111.968 176.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -130.75 106.21 15.48 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-O 120.843 0.354 . . . . 0.0 111.361 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -79.75 117.28 3.61 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.984 2.456 . . . . 0.0 111.374 174.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.9 mm -73.98 134.95 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.713 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 27.7 t80 69.12 92.73 0.08 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.906 0.754 . . . . 0.0 110.756 -177.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -80.59 110.5 16.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.392 -177.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 42.9 t -74.78 -31.43 61.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.818 177.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -99.48 107.2 19.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.659 178.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -96.83 83.76 0.78 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.234 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 50.0 pttt -141.31 152.51 44.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.815 0.34 . . . . 0.0 111.257 -176.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -95.77 -57.43 2.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.939 -179.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 55.7 mt 74.94 -15.14 0.68 Allowed 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 174.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -84.52 131.76 34.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.166 0.508 . . . . 0.0 111.65 -175.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -122.42 -50.23 2.0 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.711 173.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.1 -52.5 16.47 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.226 -0.922 . . . . 0.0 109.659 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -53.32 -51.7 61.55 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 113.677 -1.602 . . . . 0.0 110.659 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -66.73 -38.63 87.05 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.498 -1.683 . . . . 0.0 110.678 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.95 -44.55 94.33 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.177 0.298 . . . . 0.0 110.307 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.689 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.8 m -69.01 -49.99 52.77 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.691 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.43 -41.28 93.7 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -175.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.0 -39.07 89.98 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.29 -40.14 89.41 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.91 -41.01 97.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.736 178.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.11 -34.35 78.19 Favored 'General case' 0 C--O 1.21 -1.009 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.712 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.44 -34.34 74.27 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 177.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.54 -48.75 76.24 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 175.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.54 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.35 -45.51 94.08 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.392 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . 0.418 ' NE2' ' HH ' ' A' ' 129' ' ' TYR . 14.4 t-160 -62.27 -37.37 85.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.017 -178.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.91 -43.7 86.34 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 177.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.473 HD11 ' HB2' ' A' ' 57' ' ' GLN . 65.4 mt -72.28 -38.53 68.77 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.75 177.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.54 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.38 -50.85 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 120.514 0.197 . . . . 0.0 110.544 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 96.2 m -60.81 -39.46 89.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.148 0.499 . . . . 0.0 110.477 -179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.598 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.57 60.93 Favored 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.03 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.32 -37.08 84.56 Favored 'General case' 0 C--O 1.217 -0.621 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.0 t -65.59 -36.88 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.59 -40.76 80.35 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.162 0.505 . . . . 0.0 110.211 177.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 67.0 mt -71.49 -40.61 70.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.995 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.56 111.14 12.54 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.001 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -68.72 -22.69 36.94 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 122.805 2.337 . . . . 0.0 112.56 -178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.33 0.14 55.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.336 0.589 . . . . 0.0 111.121 -177.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.96 134.61 54.31 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.651 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.32 109.16 62.89 Favored Pre-proline 0 N--CA 1.446 -0.642 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.332 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.28 157.98 59.49 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.228 1.952 . . . . 0.0 111.473 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.66 154.47 25.47 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 123.598 2.865 . . . . 0.0 111.737 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.06 -30.25 69.4 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -173.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -73.59 -25.27 60.26 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.851 0.719 . . . . 0.0 111.791 -174.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.418 ' HH ' ' NE2' ' A' ' 110' ' ' HIS . 42.4 t80 -72.58 131.14 42.08 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.723 0.297 . . . . 0.0 110.39 177.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 7.6 pttm -141.46 130.02 12.27 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.254 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . 0.423 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 4.5 Cg_exo -74.56 140.0 26.23 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.813 2.342 . . . . 0.0 111.593 175.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 20.8 Cg_exo -64.88 100.26 0.35 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.176 2.584 . . . . 0.0 113.071 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -138.84 -44.22 0.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.046 178.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 7.3 t -132.78 -18.72 2.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.365 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.9 ttm180 61.21 95.88 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.854 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 18.3 t -101.46 89.46 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.622 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 8.5 p -133.82 113.86 12.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.428 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -127.43 -27.15 2.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.457 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.414 ' HD2' ' HA ' ' A' ' 139' ' ' LYS . 20.8 tptm -89.11 108.09 19.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.08 0.467 . . . . 0.0 110.845 -179.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.5 p -148.67 148.61 15.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.294 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 45.7 ttm -70.85 126.11 28.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.996 0.427 . . . . 0.0 111.366 -179.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 3.0 mt -97.96 106.08 31.99 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.81 175.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -68.05 153.63 74.55 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.972 2.448 . . . . 0.0 112.996 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -91.47 119.6 31.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.358 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.396 -0.811 . . . . 0.0 110.832 -178.244 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.544 -0.222 . . . . 0.0 112.544 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 373' ' ' HIS . . . . . 0.701 ' HB3' ' HD3' ' B' ' 374' ' ' PRO . 14.0 t-80 -92.67 -54.54 0.25 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 119.647 -0.216 . . . . 0.0 111.562 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 374' ' ' PRO . . . . . 0.701 ' HD3' ' HB3' ' B' ' 373' ' ' HIS . 13.3 Cg_exo -70.7 149.53 61.02 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.288 1.992 . . . . 0.0 113.586 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 375' ' ' THR . . . . . 0.449 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -129.01 -71.32 0.64 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.121 176.883 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 376' ' ' GLU . . . . . 0.483 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.88 -45.92 0.01 OUTLIER 'General case' 0 C--O 1.232 0.172 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 377' ' ' VAL . . . . . 0.444 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.72 151.02 7.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.423 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 378' ' ' LEU . . . . . 0.445 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.7 152.57 20.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.207 -179.014 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 379' ' ' CYS . . . . . 0.571 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.7 t -115.56 142.61 46.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.641 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . 0.418 ' HB3' ' SD ' ' B' ' 383' ' ' MET . 5.4 mt -132.73 101.49 5.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.979 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 381' ' ' MET . . . . . 0.446 ' HE2' ' SG ' ' B' ' 379' ' ' CYS . 67.2 mtt -116.95 165.7 13.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.911 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.38 51.16 8.53 Favored 'General case' 0 CA--C 1.529 0.152 0 O-C-N 123.609 0.568 . . . . 0.0 111.324 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 383' ' ' MET . . . . . 0.418 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.87 14.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.235 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 384' ' ' VAL . . . . . 0.49 HG21 HG22 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.36 125.08 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.349 . . . . 0.0 111.369 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.69 151.72 43.01 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.412 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.1 -23.44 73.42 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.306 2.004 . . . . 0.0 112.342 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.93 -5.47 53.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.504 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.04 -36.8 5.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 389' ' ' LEU . . . . . 0.458 HD13 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.96 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.55 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 390' ' ' LEU . . . . . 0.526 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.54 -15.74 5.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.676 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -98.33 148.76 23.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.555 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -73.56 -30.26 62.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.218 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.39 -47.58 26.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.794 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.54 -44.27 91.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.795 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.43 -59.33 5.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -27.33 61.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.08 -41.09 67.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.418 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 398' ' ' ILE . . . . . 0.483 HD11 HG13 ' B' ' 384' ' ' VAL . 65.6 mt -74.86 -53.74 15.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.491 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 399' ' ' VAL . . . . . 0.529 HG22 HD12 ' B' ' 417' ' ' ILE . 59.8 t -53.28 -46.91 57.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.85 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.43 -59.99 3.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.5 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.65 -57.19 11.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.39 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.12 -32.85 15.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.333 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 403' ' ' ARG . . . . . 0.45 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.2 -57.43 4.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 111.141 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.94 -33.61 64.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.205 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 405' ' ' GLU . . . . . 0.522 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.44 -47.08 44.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.001 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 406' ' ' CYS . . . . . 0.478 ' HG ' HG21 ' B' ' 434' ' ' VAL . 3.1 m -63.78 -24.04 67.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.137 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.33 1.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.97 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.04 -17.17 12.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -106.68 -15.38 14.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.594 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.15 -139.46 4.17 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.616 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 411' ' ' LEU . . . . . 0.413 ' HB3' HG23 ' B' ' 437' ' ' THR . 1.6 mm? -114.21 132.5 56.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.645 0.259 . . . . 0.0 111.11 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.41 115.37 48.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.007 0.432 . . . . 0.0 110.631 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . 0.602 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.59 -62.0 2.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.225 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.95 -169.35 3.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.109 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 415' ' ' ILE . . . . . 0.619 HG21 HG11 ' B' ' 434' ' ' VAL . 48.7 mt -145.13 128.99 12.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.842 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 416' ' ' GLU . . . . . 0.409 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.8 108.76 18.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.712 179.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 417' ' ' ILE . . . . . 0.603 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.7 mt -128.56 108.53 18.98 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.725 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 418' ' ' PRO . . . . . 0.643 ' HD2' HG23 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.45 147.61 8.85 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.664 2.243 . . . . 0.0 112.965 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 419' ' ' ARG . . . . . 0.526 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.9 74.72 21.88 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.145 179.891 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.2 117.15 2.08 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.749 2.3 . . . . 0.0 112.434 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 421' ' ' VAL . . . . . 0.51 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 95.9 t -74.44 97.82 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.171 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.59 21.77 9.05 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.596 0.713 . . . . 0.0 109.353 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 423' ' ' GLY . . . . . 0.555 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.27 29.28 6.09 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.232 -179.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 424' ' ' VAL . . . . . 0.51 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.48 -37.49 30.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -179.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.94 35.81 4.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.787 0.327 . . . . 0.0 111.774 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 426' ' ' VAL . . . . . 0.645 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.26 -44.75 48.97 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.827 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 427' ' ' PRO . . . . . 0.645 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.2 Cg_endo -66.32 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.443 2.095 . . . . 0.0 111.078 179.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.29 -15.4 3.22 Favored Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.306 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.59 149.34 50.22 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.582 0.23 . . . . 0.0 110.829 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.49 -14.16 5.07 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.879 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 431' ' ' LYS . . . . . 0.621 ' HZ3' ' HB2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -125.42 126.2 44.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 110.979 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 432' ' ' ILE . . . . . 0.643 HG23 ' HD2' ' B' ' 418' ' ' PRO . 7.9 pt -131.06 172.94 15.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.279 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 433' ' ' PHE . . . . . 0.571 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.51 -176.42 2.81 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.968 0.413 . . . . 0.0 111.994 -178.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 434' ' ' VAL . . . . . 0.619 HG11 HG21 ' B' ' 415' ' ' ILE . 3.3 m -135.76 141.76 41.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.165 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 435' ' ' GLU . . . . . 0.473 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.7 tt0 -84.35 108.48 17.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.811 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.74 168.37 12.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.239 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 437' ' ' THR . . . . . 0.602 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.5 p -94.96 -45.32 7.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.465 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.93 146.59 52.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.077 0.465 . . . . 0.0 111.165 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.17 -12.8 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.239 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -54.91 24.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.152 0.501 . . . . 0.0 110.083 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -75.1 -29.46 60.61 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.805 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -31.86 72.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.142 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.59 -47.94 16.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.703 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.7 -11.97 59.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.723 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -56.16 3.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.898 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 446' ' ' MET . . . . . 0.663 ' HE3' HG11 ' A' ' 39' ' ' VAL . 2.9 ptm -61.54 -29.71 70.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.285 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.23 -16.23 63.55 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.626 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.59 -8.63 22.57 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.443 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.2 mt -95.68 -19.78 19.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.806 0.336 . . . . 0.0 110.943 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 450' ' ' THR . . . . . 0.469 HG22 ' OG1' ' A' ' 38' ' ' THR . 21.8 p -70.71 130.06 40.76 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.992 175.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 451' ' ' GLY . . . . . 0.812 ' HA2' HG13 ' A' ' 32' ' ' VAL . . . 93.49 -8.9 74.59 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.578 177.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -77.98 -152.2 0.05 Allowed 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 117.206 0.503 . . . . 0.0 110.531 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 453' ' ' LYS . . . . . 0.472 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.11 2.29 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.858 0.361 . . . . 0.0 111.326 -179.902 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.3 -36.34 75.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.551 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.25 -50.96 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.82 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 456' ' ' ASN . . . . . 0.687 ' HB3' ' CE ' ' A' ' 27' ' ' MET . 6.3 p30 -157.2 24.94 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.753 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 457' ' ' ARG . . . . . 0.417 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.47 133.04 16.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.309 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 458' ' ' VAL . . . . . 0.411 HG23 ' HB ' ' A' ' 32' ' ' VAL . 7.1 p -64.42 135.92 27.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 O-C-N 121.656 -0.652 . . . . 0.0 111.183 -177.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 459' ' ' VAL . . . . . 0.493 HG12 HG23 ' B' ' 461' ' ' THR . 45.1 t -91.1 121.55 41.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.167 -176.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 460' ' ' VAL . . . . . 1.004 HG12 ' HB ' ' A' ' 38' ' ' THR . 4.7 m -94.35 98.09 7.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.507 0.67 . . . . 0.0 110.488 176.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 461' ' ' THR . . . . . 0.493 HG23 HG12 ' B' ' 459' ' ' VAL . 17.0 p -97.53 128.88 44.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.122 -177.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 462' ' ' LYS . . . . . 0.986 ' HD2' ' HB ' ' A' ' 40' ' ' ILE . 5.8 ptmt -130.14 -160.5 1.04 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.742 -178.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 463' ' ' TYR . . . . . 0.439 ' H ' ' HB2' ' B' ' 462' ' ' LYS . 1.2 m-85 -114.96 147.01 40.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.59 -175.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 464' ' ' CYS . . . . . 0.444 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.92 148.98 47.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.15 0.5 . . . . 0.0 111.33 -179.901 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 465' ' ' ASP . . . . . 0.449 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.39 129.42 66.33 Favored Pre-proline 0 CA--C 1.529 0.153 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.373 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 466' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.11 -33.23 73.19 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.704 2.269 . . . . 0.0 112.06 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.53 7.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.374 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 468' ' ' SER . . . . . 0.417 ' CB ' ' HB3' ' B' ' 475' ' ' TRP . 0.8 OUTLIER -57.43 -33.77 68.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 469' ' ' TYR . . . . . 0.473 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.05 -51.21 70.61 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.221 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.31 -47.59 69.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.393 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 471' ' ' ARG . . . . . 0.459 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.65 -2.11 49.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.432 -179.915 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.01 20.86 8.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.924 0.393 . . . . 0.0 110.232 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 473' ' ' ASP . . . . . 0.459 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.88 -20.82 25.14 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.947 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 62.66 53.12 2.65 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.952 0.406 . . . . 0.0 111.078 -177.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 475' ' ' TRP . . . . . 0.417 ' HB3' ' CB ' ' B' ' 468' ' ' SER . 45.6 t-105 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.877 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.2 ttp . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.957 0.408 . . . . 0.0 110.532 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.66 -45.38 0.54 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.833 178.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.7 p 54.3 -164.89 0.1 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.715 0.806 . . . . 0.0 112.534 178.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 96.97 46.62 2.4 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.643 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 57.96 -109.27 0.46 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.822 0.449 . . . . 0.0 111.617 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 70.51 133.23 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.319 0.648 . . . . 0.0 112.175 178.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.5 161.62 19.3 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.116 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.0 m -108.95 108.49 60.7 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.835 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -81.08 146.8 16.19 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.765 2.31 . . . . 0.0 113.205 -178.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 10' ' ' LEU . 6.9 mt -133.82 10.72 3.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.565 177.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -86.87 174.27 8.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.961 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -86.53 147.33 43.82 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.878 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.18 115.53 2.54 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.932 2.422 . . . . 0.0 112.32 177.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.02 -166.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.85 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.44 51.92 12.11 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.896 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.4 -36.21 3.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.927 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.72 91.85 2.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.96 -54.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.837 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.14 13.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.945 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.9 125.57 24.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.806 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.62 12.83 19.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.982 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.519 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 72.0 m95 -142.02 53.1 1.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.756 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.28 -156.64 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.794 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.476 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.25 -37.73 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.852 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.71 120.58 40.56 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.534 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.6 p -136.8 169.13 18.25 Favored 'General case' 0 C--N 1.331 -0.239 0 O-C-N 124.007 0.817 . . . . 0.0 110.869 -178.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.506 ' HG3' ' HG2' ' A' ' 28' ' ' GLU . 24.9 ptt? -96.15 -18.74 19.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.5 177.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.506 ' HG2' ' HG3' ' A' ' 27' ' ' MET . 33.1 mm-40 -108.86 101.73 10.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.694 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -104.21 125.0 50.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.667 178.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -85.93 -76.19 0.35 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.973 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.5 p -141.64 -46.04 0.36 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.144 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.606 ' HB ' ' HB3' ' B' ' 457' ' ' ARG . 58.5 t -86.76 143.78 10.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.301 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.837 ' HB ' ' HD2' ' A' ' 34' ' ' PRO . 1.1 pp -126.8 169.19 12.51 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.288 -177.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.837 ' HD2' ' HB ' ' A' ' 33' ' ' ILE . 59.2 Cg_endo -71.13 159.75 51.24 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.833 2.355 . . . . 0.0 114.409 -173.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -148.35 -136.71 2.76 Favored Glycine 0 C--N 1.332 0.34 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.413 175.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.66 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 26.9 ttt -154.79 -58.56 0.02 OUTLIER Pre-proline 0 CA--C 1.536 0.435 0 CA-C-N 116.871 0.335 . . . . 0.0 111.593 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.66 ' HD3' ' HB3' ' A' ' 36' ' ' MET . 93.6 Cg_endo -81.81 124.06 4.38 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 121.776 1.65 . . . . 0.0 111.872 177.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.707 ' HB ' ' HA ' ' B' ' 460' ' ' VAL . 41.0 p -130.5 -22.17 2.76 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.65 -177.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.2 m -53.37 120.73 1.95 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-O 121.299 0.571 . . . . 0.0 111.999 -176.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.808 ' H ' ' HG2' ' B' ' 462' ' ' LYS . 58.8 mt -109.48 122.75 38.53 Favored Pre-proline 0 CA--C 1.532 0.261 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.495 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.23 157.57 13.85 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 123.767 2.978 . . . . 0.0 113.606 -177.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.446 ' HB3' ' HE1' ' B' ' 475' ' ' TRP . 46.5 Cg_endo -70.97 112.48 3.3 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.719 2.28 . . . . 0.0 113.477 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 124.02 54.53 0.19 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.574 175.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.447 ' HB3' ' HG3' ' A' ' 49' ' ' GLU . 3.6 mm? -126.89 150.02 49.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.93 0.395 . . . . 0.0 111.479 -175.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.414 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 7.6 p -90.76 155.93 18.44 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.35 173.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.41 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -63.01 -31.29 72.4 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 120.933 0.397 . . . . 0.0 111.388 -174.253 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.414 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.35 -45.06 61.53 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.29 -33.49 73.27 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.763 -177.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.454 ' O ' HG12 ' A' ' 53' ' ' ILE . 43.6 mt-10 -61.04 -44.54 97.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.21 177.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -62.77 -43.38 98.94 Favored 'General case' 0 C--O 1.185 -2.318 0 CA-C-O 118.884 -0.579 . . . . 0.0 110.234 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.427 ' HA ' HG21 ' A' ' 54' ' ' VAL . . . -58.41 -43.41 88.62 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 123.739 0.65 . . . . 0.0 111.535 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -65.4 -39.07 91.74 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.858 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.667 ' HA ' HD21 ' A' ' 56' ' ' LEU . 36.0 mm -78.64 -41.09 24.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.365 -178.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.43 ' O ' HG13 ' A' ' 58' ' ' ILE . 35.1 m -65.57 -35.5 75.39 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.84 0 CA-C-O 118.664 -0.684 . . . . 0.0 111.898 176.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.05 -43.04 91.65 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.509 0.595 . . . . 0.0 110.353 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.667 HD21 ' HA ' ' A' ' 53' ' ' ILE . 0.3 OUTLIER -64.93 -38.62 91.56 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.646 177.55 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.476 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 61.8 mt-30 -75.14 -30.37 60.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.421 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.46 HD13 HD11 ' A' ' 113' ' ' ILE . 72.5 mt -65.8 -47.02 87.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 122.836 0.454 . . . . 0.0 110.341 175.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.42 -41.16 85.3 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.64 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -70.33 -31.37 68.64 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.225 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.807 ' HG ' HG12 ' A' ' 33' ' ' ILE . 17.8 mt -67.64 -44.92 76.76 Favored 'General case' 0 C--O 1.207 -1.162 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 172.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.5 -35.81 82.0 Favored 'General case' 0 N--CA 1.432 -1.346 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -178.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.485 ' O ' HG23 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.79 -42.76 76.05 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.557 ' HZ2' HG21 ' A' ' 33' ' ' ILE . 22.1 ttmt -61.79 -47.76 83.68 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 113.846 -1.524 . . . . 0.0 111.93 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.04 -29.0 63.73 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.867 176.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.96 -47.13 69.47 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.485 HG23 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.07 -17.69 14.41 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 119.974 -0.69 . . . . 0.0 112.815 -177.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.89 29.41 10.6 Favored Glycine 0 C--N 1.315 -0.621 0 C-N-CA 119.896 -1.145 . . . . 0.0 111.254 -177.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.4 92.95 7.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.214 0.531 . . . . 0.0 110.135 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.8 tp -103.39 -39.69 6.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.536 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.98 108.54 3.18 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.781 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.429 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 43.2 mm -105.81 113.2 64.13 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 110.655 177.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 72' ' ' ILE . 8.3 Cg_exo -72.47 150.08 51.2 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.065 2.51 . . . . 0.0 112.4 179.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.73 144.7 97.82 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.906 2.404 . . . . 0.0 112.532 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 65.8 t30 65.34 99.73 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.458 0 O-C-N 123.722 0.639 . . . . 0.0 110.784 -176.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.64 173.73 13.86 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.85 2.366 . . . . 0.0 113.22 -176.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -95.3 156.95 16.1 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.048 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 62.33 -164.34 0.25 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.026 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -82.41 -53.45 5.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 0.0 110.048 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 m -126.28 115.46 23.53 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.29 159.64 46.27 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.875 2.383 . . . . 0.0 112.973 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 36.2 t -59.87 137.12 90.46 Favored Pre-proline 0 CA--C 1.532 0.261 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.476 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -54.55 130.25 39.14 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.36 2.707 . . . . 0.0 112.981 178.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.589 ' HB3' ' HD3' ' A' ' 85' ' ' PRO . 22.3 tt0 -125.65 -54.8 0.03 OUTLIER Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.174 -176.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.589 ' HD3' ' HB3' ' A' ' 84' ' ' GLU . 3.6 Cg_exo -75.26 -28.38 8.8 Favored 'Trans proline' 0 C--N 1.362 1.26 0 C-N-CA 122.589 2.193 . . . . 0.0 113.363 -177.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.9 mm -77.89 126.32 38.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.85 0.357 . . . . 0.0 111.191 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -127.8 135.99 50.86 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.601 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -81.62 115.89 21.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.094 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 89.2 p -74.56 -30.41 61.72 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.375 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -83.02 -67.96 0.74 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.022 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 127.68 114.98 1.87 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.791 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.7 tttp -117.24 -32.55 4.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.106 0.479 . . . . 0.0 110.261 177.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -118.97 -169.45 1.73 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.36 178.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 mt -105.72 171.77 7.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.769 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -76.34 100.77 5.25 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.163 175.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -136.22 -50.13 0.68 Allowed 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 115.738 -0.664 . . . . 0.0 112.73 -175.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.09 -52.53 16.36 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.218 -0.926 . . . . 0.0 109.667 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.6 mp0 -53.34 -51.74 61.46 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-N 113.614 -1.63 . . . . 0.0 110.66 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -66.61 -38.75 87.63 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 113.456 -1.702 . . . . 0.0 110.653 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.514 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.87 -44.51 94.12 Favored 'General case' 0 CA--C 1.512 -0.495 0 O-C-N 123.265 0.353 . . . . 0.0 110.356 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.71 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.8 m -69.02 -50.05 52.26 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 120.069 -0.653 . . . . 0.0 110.637 179.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.45 -41.24 93.66 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -175.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.08 -39.1 89.78 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.525 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.19 -40.16 89.07 Favored 'General case' 0 C--O 1.223 -0.308 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.71 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.93 -41.09 97.73 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.648 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.0 -34.45 78.47 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.73 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.44 -34.29 74.21 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.55 -48.79 76.05 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.607 -1.256 . . . . 0.0 107.607 175.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.549 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.24 -45.54 94.11 Favored 'General case' 0 C--O 1.213 -0.819 0 CA-C-N 114.494 -1.23 . . . . 0.0 110.436 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.28 -37.42 85.46 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.565 0.746 . . . . 0.0 110.99 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.78 -43.74 85.78 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.7 mt -72.23 -38.63 68.92 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.769 177.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.39 -50.91 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 110.51 -0.181 . . . . 0.0 110.51 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.5 m -60.7 -39.46 88.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.195 0.521 . . . . 0.0 110.535 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.598 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.52 61.24 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.004 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.43 -37.09 84.41 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.8 t -65.54 -36.86 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 176.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.72 80.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.226 0.536 . . . . 0.0 110.23 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.7 mt -71.61 -40.5 69.77 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.984 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.58 111.19 12.53 Favored Pre-proline 0 C--N 1.315 -0.896 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.013 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.68 -22.81 36.99 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.837 2.358 . . . . 0.0 112.558 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.16 0.01 55.98 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.191 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.94 134.7 54.53 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.617 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.39 109.07 62.8 Favored Pre-proline 0 CA--C 1.51 -0.589 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.32 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.23 157.93 59.67 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 122.261 1.974 . . . . 0.0 111.501 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.64 154.5 25.23 Favored 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 123.626 2.884 . . . . 0.0 111.768 177.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.08 -31.37 70.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -91.77 34.96 0.97 Allowed 'General case' 0 C--O 1.233 0.22 0 O-C-N 123.474 0.484 . . . . 0.0 111.618 -177.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -73.51 125.32 27.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.215 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -106.86 111.6 63.72 Favored Pre-proline 0 C--O 1.234 0.238 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.247 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -77.94 158.36 30.93 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.401 2.734 . . . . 0.0 112.201 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -64.2 161.46 33.89 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.75 2.3 . . . . 0.0 112.789 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . 61.06 -148.44 0.42 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.56 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.7 m 71.14 95.74 0.07 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.964 178.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -109.4 -41.97 4.47 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.38 175.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 22.5 m -101.08 162.11 3.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.406 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 74.4 m -126.2 130.39 50.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.455 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -78.26 98.4 5.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.112 0.482 . . . . 0.0 110.682 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 57.5 tttm -102.1 124.61 47.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.173 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 16.1 m -83.99 144.32 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.585 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.13 133.74 23.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.027 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 18.6 pt -85.5 153.68 58.84 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.233 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -57.18 133.04 54.97 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.926 2.417 . . . . 0.0 112.697 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -80.81 127.43 32.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.019 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.068 -0.968 . . . . 0.0 111.01 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 N-CA-C 112.669 -0.172 . . . . 0.0 112.669 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 373' ' ' HIS . . . . . 0.431 ' HA ' ' HD3' ' B' ' 374' ' ' PRO . 95.9 m-70 -86.48 134.12 38.72 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.596 0.198 . . . . 0.0 110.905 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 374' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 373' ' ' HIS . 31.8 Cg_exo -59.5 147.6 90.77 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.985 2.457 . . . . 0.0 112.529 178.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 375' ' ' THR . . . . . 0.456 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -143.35 -71.42 0.31 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.179 -177.557 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 376' ' ' GLU . . . . . 0.473 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.9 -45.91 0.01 OUTLIER 'General case' 0 C--O 1.231 0.108 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 377' ' ' VAL . . . . . 0.431 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.95 7.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.478 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 378' ' ' LEU . . . . . 0.45 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.63 152.5 20.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.193 -178.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 379' ' ' CYS . . . . . 0.571 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.53 142.53 46.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.631 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . 0.617 HD22 HG22 ' B' ' 461' ' ' THR . 5.3 mt -132.71 102.33 5.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.377 . . . . 0.0 111.01 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 21.6 ttt -117.15 164.89 14.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.26 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.2 t30 58.15 51.12 8.97 Favored 'General case' 0 C--O 1.232 0.154 0 O-C-N 123.338 0.399 . . . . 0.0 111.278 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 383' ' ' MET . . . . . 0.787 ' HB3' HG13 ' B' ' 459' ' ' VAL . 3.0 ptm -164.86 14.37 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.258 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 384' ' ' VAL . . . . . 0.491 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.27 125.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 0.0 111.372 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . . . . . . . . . 20.1 mt -110.83 151.7 43.08 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.4 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.07 -23.52 73.62 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.353 2.035 . . . . 0.0 112.36 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.89 -5.48 53.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.494 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.77 5.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.872 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 389' ' ' LEU . . . . . 0.453 HD13 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.97 0.46 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.969 0.414 . . . . 0.0 110.615 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 390' ' ' LEU . . . . . 0.525 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.58 -15.72 5.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.652 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.36 148.76 23.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.542 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -73.57 -30.16 62.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.276 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.42 -47.66 26.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.713 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.6 -44.25 91.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.743 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.44 -59.32 5.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.221 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -27.38 61.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.27 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.08 -41.06 67.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.423 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 398' ' ' ILE . . . . . 0.476 HD11 HG11 ' B' ' 384' ' ' VAL . 65.5 mt -74.94 -53.64 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.516 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 399' ' ' VAL . . . . . 0.561 HG22 HD12 ' B' ' 417' ' ' ILE . 59.4 t -53.25 -46.98 57.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.807 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.42 -60.0 3.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.789 0.328 . . . . 0.0 111.523 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.52 -57.31 11.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.359 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.01 -32.96 15.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.326 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 403' ' ' ARG . . . . . 0.45 ' HA ' HD13 ' B' ' 415' ' ' ILE . 0.2 OUTLIER -71.18 -57.38 4.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.715 0.293 . . . . 0.0 111.149 -179.919 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.93 -33.69 64.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.15 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 405' ' ' GLU . . . . . 0.519 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.43 -47.02 45.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.96 -23.87 67.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.171 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.39 1.1 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.966 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.1 -17.17 12.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.877 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 409' ' ' TYR . . . . . 0.478 ' HH ' HD23 ' B' ' 449' ' ' LEU . 1.9 m-85 -106.61 -15.47 14.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.561 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.12 -139.41 4.15 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.536 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 411' ' ' LEU . . . . . 0.428 ' HB3' HG23 ' B' ' 437' ' ' THR . 1.6 mm? -114.29 132.46 56.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.714 0.292 . . . . 0.0 111.065 -179.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.39 115.46 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.991 0.424 . . . . 0.0 110.58 179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . 0.602 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.64 -61.93 2.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.226 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.04 -169.4 3.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.109 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 415' ' ' ILE . . . . . 0.604 HG22 HG11 ' B' ' 434' ' ' VAL . 48.8 mt -145.09 128.83 11.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 416' ' ' GLU . . . . . 0.422 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.78 108.83 18.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.732 179.781 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 417' ' ' ILE . . . . . 0.595 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.5 mt -128.53 108.47 19.04 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.708 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 418' ' ' PRO . . . . . 0.655 ' HD2' HG21 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.5 147.6 9.01 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.663 2.242 . . . . 0.0 112.904 -179.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 419' ' ' ARG . . . . . 0.525 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.84 74.75 22.06 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.143 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.27 117.11 2.07 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.79 2.327 . . . . 0.0 112.402 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 421' ' ' VAL . . . . . 0.509 ' N ' ' HB ' ' B' ' 424' ' ' VAL . 96.5 t -74.39 97.78 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.187 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.57 21.82 9.06 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.557 0.694 . . . . 0.0 109.314 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 423' ' ' GLY . . . . . 0.425 ' HA2' HG21 ' B' ' 426' ' ' VAL . . . 102.39 29.22 6.07 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.278 -179.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 424' ' ' VAL . . . . . 0.509 ' HB ' ' N ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.5 -37.6 30.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.103 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.84 35.97 4.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.804 0.335 . . . . 0.0 111.753 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 426' ' ' VAL . . . . . 0.649 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.39 -44.63 47.0 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.819 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 427' ' ' PRO . . . . . 0.649 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.33 77.07 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.473 2.115 . . . . 0.0 111.107 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.31 -15.38 3.21 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.313 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.2 t -67.52 149.39 50.23 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.511 0.196 . . . . 0.0 110.885 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.5 -14.27 5.06 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.912 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.37 126.17 44.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.845 0.355 . . . . 0.0 111.08 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 432' ' ' ILE . . . . . 0.655 HG21 ' HD2' ' B' ' 418' ' ' PRO . 7.9 pt -131.08 172.93 15.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.281 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 433' ' ' PHE . . . . . 0.571 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.37 2.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.958 0.409 . . . . 0.0 111.962 -178.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 434' ' ' VAL . . . . . 0.604 HG11 HG22 ' B' ' 415' ' ' ILE . 3.3 m -135.82 141.72 41.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.176 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 435' ' ' GLU . . . . . 0.475 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.4 108.55 17.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.821 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.78 168.37 12.52 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.249 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 437' ' ' THR . . . . . 0.602 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -94.96 -45.43 7.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.404 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.85 146.69 52.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.128 0.489 . . . . 0.0 111.183 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.22 -12.84 16.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.192 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.8 26.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.123 0.487 . . . . 0.0 110.129 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.15 -29.44 60.48 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.889 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.14 -31.81 72.34 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.186 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.69 -48.03 15.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.646 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.07 59.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.709 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.83 -54.9 3.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.961 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 446' ' ' MET . . . . . 0.42 ' O ' HG21 ' B' ' 450' ' ' THR . 4.1 ptm -64.76 -27.57 68.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.957 -179.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.58 -16.2 63.36 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.64 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.66 -8.53 22.57 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.464 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 449' ' ' LEU . . . . . 0.478 HD23 ' HH ' ' B' ' 409' ' ' TYR . 97.3 mt -95.82 -19.77 19.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.712 0.291 . . . . 0.0 110.916 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 450' ' ' THR . . . . . 0.443 HG22 ' OG1' ' A' ' 38' ' ' THR . 23.1 p -69.54 131.36 44.57 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.104 175.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.63 -9.59 76.66 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.677 -0.773 . . . . 0.0 113.377 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -75.74 -152.2 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 117.2 0.5 . . . . 0.0 110.513 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 453' ' ' LYS . . . . . 0.513 ' HZ2' ' HA ' ' A' ' 33' ' ' ILE . 0.0 OUTLIER -160.87 117.15 2.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.948 0.404 . . . . 0.0 111.338 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.23 -36.4 75.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.542 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.21 -50.98 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.846 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.25 25.0 0.3 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.787 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 457' ' ' ARG . . . . . 0.606 ' HB3' ' HB ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -149.47 136.22 19.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.325 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 458' ' ' VAL . . . . . 0.412 HG12 HE21 ' A' ' 57' ' ' GLN . 7.2 p -58.38 132.23 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 121.124 0.488 . . . . 0.0 110.949 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 459' ' ' VAL . . . . . 0.787 HG13 ' HB3' ' B' ' 383' ' ' MET . 0.9 OUTLIER -90.99 122.12 42.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.819 -174.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 460' ' ' VAL . . . . . 0.754 HG13 HD13 ' A' ' 40' ' ' ILE . 59.6 t -88.89 98.21 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.319 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 461' ' ' THR . . . . . 0.617 HG22 HD22 ' B' ' 380' ' ' LEU . 1.4 p -98.12 129.64 44.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.842 177.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 462' ' ' LYS . . . . . 0.808 ' HG2' ' H ' ' A' ' 40' ' ' ILE . 0.5 OUTLIER -130.58 -166.35 1.67 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.268 0.556 . . . . 0.0 111.148 -179.045 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.59 146.93 37.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.525 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 464' ' ' CYS . . . . . 0.609 ' SG ' ' HB3' ' B' ' 475' ' ' TRP . 0.5 OUTLIER -136.81 148.98 47.48 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.065 0.46 . . . . 0.0 111.378 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 465' ' ' ASP . . . . . 0.456 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.46 129.35 66.42 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.398 -179.881 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 466' ' ' PRO . . . . . 0.473 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.06 -33.21 72.62 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.685 2.257 . . . . 0.0 112.103 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.07 -58.48 7.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.38 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.5 -33.67 68.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.25 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 469' ' ' TYR . . . . . 0.475 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.1 -51.18 70.7 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.183 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.37 -47.53 69.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.37 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 471' ' ' ARG . . . . . 0.457 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.73 -2.09 49.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.45 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.09 20.8 8.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.975 0.417 . . . . 0.0 110.275 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 473' ' ' ASP . . . . . 0.457 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.85 -21.48 29.49 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.954 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 70.05 157.29 0.16 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.121 0.568 . . . . 0.0 111.264 -177.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 475' ' ' TRP . . . . . 0.609 ' HB3' ' SG ' ' B' ' 464' ' ' CYS . 44.0 t-105 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.359 -0.829 . . . . 0.0 111.226 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.1 mtp . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 120.446 0.165 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 61.41 -101.42 0.11 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.771 0.669 . . . . 0.0 111.84 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 t -147.42 -9.64 0.43 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.197 0.523 . . . . 0.0 110.422 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.73 -4.89 0.11 Allowed Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.208 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 60.46 -160.13 0.3 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.945 0.498 . . . . 0.0 111.73 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -85.8 148.22 25.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.421 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.91 143.82 32.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.05 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.0 t -72.34 128.52 88.69 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.795 178.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 31.2 Cg_exo -59.88 137.8 78.64 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.944 2.429 . . . . 0.0 112.652 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.415 HD12 ' HA ' ' A' ' 10' ' ' LEU . 11.9 tp -98.44 16.14 22.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.056 177.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -75.19 -43.71 50.58 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.785 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 31.3 p90 -78.55 146.22 69.13 Favored Pre-proline 0 C--O 1.233 0.189 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.279 176.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 38.8 Cg_exo -56.52 115.56 2.57 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 123.265 2.643 . . . . 0.0 112.323 -174.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.92 12.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.94 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.36 -36.27 3.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.995 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.8 2.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.856 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.84 -54.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.812 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.9 111.13 13.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.94 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.92 125.59 24.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.697 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.62 12.88 19.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.992 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.518 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.8 m95 -142.06 53.02 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.706 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.29 -156.54 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.84 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.465 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.33 -37.63 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.867 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.75 121.29 42.86 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.557 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 p -121.99 -64.63 1.19 Allowed 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.625 0.578 . . . . 0.0 111.067 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mpt? 59.67 29.23 18.78 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.636 0.585 . . . . 0.0 111.421 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -103.45 -57.7 2.0 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.22 178.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -156.95 172.17 19.14 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.259 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 44.2 mtpt 63.53 -157.43 0.32 Allowed 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.468 0.48 . . . . 0.0 111.715 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 40.0 p -92.94 130.6 38.47 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.868 0.366 . . . . 0.0 111.559 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.1 p -127.53 135.42 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.371 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.746 HG23 ' HZ2' ' B' ' 453' ' ' LYS . 0.0 OUTLIER -143.84 136.42 13.5 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.418 177.593 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.593 ' HD2' HG12 ' A' ' 33' ' ' ILE . 76.1 Cg_exo -52.27 160.2 3.6 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 123.227 2.618 . . . . 0.0 113.367 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -73.52 89.49 0.63 Allowed Glycine 0 N--CA 1.451 -0.346 0 CA-C-N 115.776 -0.647 . . . . 0.0 113.125 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.423 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 24.0 mmt -115.33 133.61 22.7 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 120.641 0.258 . . . . 0.0 111.132 178.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 36' ' ' MET . 24.6 Cg_exo -63.78 134.91 45.9 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.903 2.402 . . . . 0.0 111.955 176.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.563 ' HG1' HD22 ' A' ' 56' ' ' LEU . 13.6 t -153.93 23.82 0.5 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.957 0.408 . . . . 0.0 110.949 -176.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.7 m -52.84 119.76 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.257 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.809 ' H ' HG11 ' B' ' 460' ' ' VAL . 84.2 mt -64.85 132.78 95.55 Favored Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.135 177.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.47 ' HA ' ' HD3' ' A' ' 42' ' ' PRO . 26.1 Cg_exo -64.56 147.38 90.24 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 122.67 2.247 . . . . 0.0 112.198 175.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 9.8 Cg_exo -72.31 104.59 1.71 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.916 2.41 . . . . 0.0 113.019 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 136.1 46.51 0.09 OUTLIER Glycine 0 C--N 1.333 0.382 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.46 176.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 44' ' ' LEU . 3.4 mm? -121.63 156.84 32.11 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.927 0.394 . . . . 0.0 111.521 -176.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.449 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 1.4 p -84.93 154.27 22.31 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.605 175.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.415 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.06 -31.3 71.71 Favored 'General case' 0 C--O 1.24 0.597 0 O-C-N 123.368 0.418 . . . . 0.0 111.395 -175.029 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.449 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.3 -45.23 60.91 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.18 -32.69 72.17 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.753 -177.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.439 ' O ' HG12 ' A' ' 53' ' ' ILE . 36.1 mt-10 -61.16 -44.78 96.78 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.243 178.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.437 ' O ' HG21 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.37 -43.32 97.94 Favored 'General case' 0 C--O 1.186 -2.252 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.235 177.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.456 ' HA ' HG21 ' A' ' 54' ' ' VAL . . . -58.43 -42.13 86.61 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 123.719 0.637 . . . . 0.0 111.585 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -66.29 -38.86 88.76 Favored 'General case' 0 N--CA 1.462 0.165 0 O-C-N 123.824 0.703 . . . . 0.0 110.933 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.584 ' HA ' HD21 ' A' ' 56' ' ' LEU . 29.6 mm -78.31 -41.52 26.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.197 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.456 HG21 ' HA ' ' A' ' 51' ' ' ALA . 35.0 m -66.41 -35.44 74.92 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.809 0 CA-C-O 118.586 -0.721 . . . . 0.0 111.958 177.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.15 -45.43 90.99 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 118.541 0.61 . . . . 0.0 110.308 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.584 HD21 ' HA ' ' A' ' 53' ' ' ILE . 0.1 OUTLIER -70.55 -23.71 62.67 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.077 -178.321 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -89.53 -26.67 20.75 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.669 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.462 HD12 HD11 ' A' ' 113' ' ' ILE . 72.7 mt -64.04 -46.94 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.175 0.59 . . . . 0.0 110.395 170.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.405 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.45 -41.15 85.17 Favored 'General case' 0 CA--C 1.513 -0.474 0 C-N-CA 120.294 -0.563 . . . . 0.0 110.685 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -36.5 83.11 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.844 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -66.61 -44.95 80.71 Favored 'General case' 0 C--O 1.206 -1.187 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.51 -35.81 81.98 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.468 ' O ' HG21 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.82 -42.76 76.19 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 122.095 0.95 . . . . 0.0 108.53 176.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.519 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.76 -47.73 83.88 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 113.827 -1.533 . . . . 0.0 111.897 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.23 -28.79 63.39 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 119.741 -0.784 . . . . 0.0 111.831 176.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -68.1 -47.07 69.19 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.468 HG21 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.48 14.46 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 119.965 -0.694 . . . . 0.0 112.86 -177.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.77 29.41 10.74 Favored Glycine 0 C--N 1.316 -0.565 0 C-N-CA 119.804 -1.188 . . . . 0.0 111.28 -177.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.4 91.08 6.77 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.253 0.549 . . . . 0.0 110.215 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -122.68 -32.43 3.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.454 178.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 138.2 -168.12 24.71 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.354 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.452 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 44.6 mm -94.79 113.11 60.41 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.796 0.331 . . . . 0.0 110.687 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 72' ' ' ILE . 5.8 Cg_exo -79.54 152.61 23.13 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 123.087 2.525 . . . . 0.0 112.253 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.6 -28.55 52.78 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.713 2.275 . . . . 0.0 112.279 177.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -100.21 124.79 41.92 Favored Pre-proline 0 CA--C 1.53 0.191 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.708 178.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.22 143.42 53.4 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.883 2.389 . . . . 0.0 112.33 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -110.32 -31.42 7.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.36 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -124.17 31.09 5.89 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.864 -176.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 85.1 mtt180 -124.02 -27.28 3.91 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.658 0.266 . . . . 0.0 111.57 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.8 p -88.88 153.81 49.73 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.935 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.52 130.89 35.42 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.05 2.5 . . . . 0.0 112.486 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 29.3 t -138.64 93.64 10.84 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.127 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -90.28 121.83 0.92 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.264 2.642 . . . . 0.0 112.686 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -148.43 106.72 3.55 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.948 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo -72.97 151.63 50.62 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.918 2.412 . . . . 0.0 112.066 177.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.8 pt -89.92 109.82 21.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.102 0.477 . . . . 0.0 111.575 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -128.21 -41.75 1.56 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.241 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -103.83 134.23 47.49 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.55 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 57.9 m -71.0 -47.52 58.31 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.295 -177.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -103.73 88.58 3.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.026 0.441 . . . . 0.0 110.498 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -91.34 165.67 30.22 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.659 -177.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 89.6 mttt 60.27 85.2 0.11 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.158 0.504 . . . . 0.0 111.699 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -112.71 5.06 17.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.864 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -103.58 -78.37 0.55 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.959 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 66.79 104.2 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.316 0.647 . . . . 0.0 112.374 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -111.86 -50.19 2.93 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.774 174.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.11 -52.5 16.46 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.261 -0.9 . . . . 0.0 109.706 -178.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.3 mp0 -53.34 -51.7 61.58 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-N 113.663 -1.608 . . . . 0.0 110.656 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.64 -38.75 87.55 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.435 -1.712 . . . . 0.0 110.704 -177.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.513 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.83 -44.59 93.98 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 123.237 0.336 . . . . 0.0 110.371 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.705 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.7 m -69.05 -50.0 52.49 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.613 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.46 -41.27 93.55 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -175.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.0 -39.17 90.05 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 110.351 -0.241 . . . . 0.0 110.351 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.23 -40.13 89.12 Favored 'General case' 0 C--O 1.223 -0.308 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.705 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.93 -41.06 97.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.135 -0.938 . . . . 0.0 110.663 178.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.01 -34.36 78.26 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.811 178.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.52 -34.29 74.05 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 177.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.45 -48.86 75.99 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 175.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.547 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.2 ttp180 -61.26 -45.51 94.21 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.441 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.21 -37.47 85.47 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 123.567 0.747 . . . . 0.0 111.016 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.79 -43.73 85.8 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.8 mt -72.3 -38.49 68.73 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.814 177.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.4 -50.98 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 110.472 -0.195 . . . . 0.0 110.472 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.9 m -60.6 -39.6 88.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.219 0.533 . . . . 0.0 110.514 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.593 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.89 -49.64 60.83 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.952 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.1 84.46 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.3 t -65.52 -36.87 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 176.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.7 79.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.197 0.523 . . . . 0.0 110.22 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.3 mt -71.46 -40.56 70.23 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.045 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.63 111.22 12.48 Favored Pre-proline 0 C--N 1.316 -0.853 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.76 -22.63 36.8 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.861 2.374 . . . . 0.0 112.588 -178.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.34 0.07 55.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.405 0.621 . . . . 0.0 111.178 -177.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.84 134.61 54.43 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.61 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.35 109.16 62.89 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.323 177.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.27 157.92 59.76 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.271 1.981 . . . . 0.0 111.501 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.56 154.5 24.82 Favored 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 123.648 2.899 . . . . 0.0 111.813 177.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.1 -31.49 71.13 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -90.08 20.73 4.1 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 123.771 0.669 . . . . 0.0 111.733 -176.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -74.15 119.86 18.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.815 0.34 . . . . 0.0 110.151 175.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' A' ' 131' ' ' PRO . 53.2 tttt -108.74 120.0 47.46 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.919 -178.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 130' ' ' LYS . 18.7 Cg_exo -66.34 135.51 40.04 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 123.049 2.5 . . . . 0.0 112.424 179.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -64.24 -43.8 13.71 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.181 2.587 . . . . 0.0 112.81 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -127.7 125.84 40.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.977 0.417 . . . . 0.0 111.278 -179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 27.9 p -111.44 125.73 54.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.906 178.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -88.14 161.0 17.53 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.239 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 17.5 m -89.02 -20.65 7.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.419 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 71.3 m -116.99 98.52 6.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.792 0.33 . . . . 0.0 110.896 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -100.01 110.07 22.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.597 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 12.2 pttm -79.47 -22.02 44.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.626 -178.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 2.7 m -81.55 121.81 35.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.105 0.479 . . . . 0.0 111.152 178.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 21.8 mmt -110.67 155.84 21.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 -178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.689 ' H ' HD12 ' A' ' 142' ' ' ILE . 0.2 OUTLIER -95.04 147.65 33.39 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.556 177.041 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 142' ' ' ILE . 24.6 Cg_exo -63.59 131.54 31.97 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.678 2.252 . . . . 0.0 112.11 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -104.79 162.36 13.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.029 -179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.432 -0.794 . . . . 0.0 110.964 -179.634 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.145 0 N-CA-C 112.599 -0.2 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -94.63 132.7 28.11 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 120.679 0.276 . . . . 0.0 111.148 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -69.05 142.68 51.78 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.943 2.429 . . . . 0.0 112.973 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 375' ' ' THR . . . . . 0.441 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -120.84 -71.3 0.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.166 178.638 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 376' ' ' GLU . . . . . 0.48 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.96 0.01 OUTLIER 'General case' 0 C--O 1.231 0.097 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 377' ' ' VAL . . . . . 0.447 HG23 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.95 7.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.471 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 378' ' ' LEU . . . . . 0.448 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.55 152.54 20.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.271 -179.072 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 379' ' ' CYS . . . . . 0.578 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.57 142.53 46.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.59 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . 0.411 HD13 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.73 101.82 5.43 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.925 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 20.3 ttt -116.83 164.7 14.27 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.59 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.1 t30 58.58 51.19 8.14 Favored 'General case' 0 C--N 1.342 0.278 0 O-C-N 123.479 0.487 . . . . 0.0 111.316 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 383' ' ' MET . . . . . 0.409 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.85 14.4 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.253 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 384' ' ' VAL . . . . . 0.479 HG11 HD11 ' B' ' 398' ' ' ILE . 0.5 OUTLIER -152.31 125.17 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.845 0.355 . . . . 0.0 111.311 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.4 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.0 mt -110.78 151.78 43.1 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.34 179.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.25 -23.35 72.5 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.273 1.982 . . . . 0.0 112.343 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.94 -5.52 53.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.484 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.02 -36.76 5.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.904 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 389' ' ' LEU . . . . . 0.437 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.96 34.92 0.46 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.913 0.387 . . . . 0.0 110.636 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 390' ' ' LEU . . . . . 0.522 HD22 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.55 -15.66 5.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.659 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.31 148.71 23.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.573 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -73.5 -30.25 63.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.225 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.35 -47.68 26.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.754 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.51 -44.26 91.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.852 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.41 -59.45 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.162 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -27.29 61.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.275 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.23 -40.94 67.39 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.429 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 398' ' ' ILE . . . . . 0.479 HD11 HG11 ' B' ' 384' ' ' VAL . 65.5 mt -74.93 -53.65 16.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.525 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 399' ' ' VAL . . . . . 0.584 HG23 HD12 ' B' ' 417' ' ' ILE . 59.7 t -53.3 -46.86 57.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.846 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.47 -60.0 3.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.74 0.305 . . . . 0.0 111.526 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.69 -57.14 11.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.341 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.7 t -52.04 -32.99 15.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.387 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 403' ' ' ARG . . . . . 0.45 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.15 -57.39 4.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 111.173 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.9 -33.62 64.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.214 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 405' ' ' GLU . . . . . 0.518 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 22.0 mm-40 -73.48 -47.06 44.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.963 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.81 -23.97 67.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.131 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.08 30.25 1.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.895 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.01 -17.18 12.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.42 14.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.551 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.14 -139.46 4.17 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.553 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 411' ' ' LEU . . . . . 0.416 ' HB3' HG22 ' B' ' 437' ' ' THR . 1.6 mm? -114.21 132.51 56.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.09 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.38 115.45 48.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.028 0.442 . . . . 0.0 110.658 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . 0.602 ' HG3' HG21 ' B' ' 437' ' ' THR . 10.9 mttt -56.69 -61.97 2.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.179 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.96 -169.33 3.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.188 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 415' ' ' ILE . . . . . 0.568 HG22 HG11 ' B' ' 434' ' ' VAL . 48.6 mt -145.2 128.94 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.825 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 416' ' ' GLU . . . . . 0.414 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.93 108.76 18.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.692 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 417' ' ' ILE . . . . . 0.599 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.1 mt -128.42 108.48 19.24 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.688 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 418' ' ' PRO . . . . . 0.649 ' HD2' HG21 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.48 147.61 8.95 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.673 2.248 . . . . 0.0 112.913 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 419' ' ' ARG . . . . . 0.522 HH21 HD22 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.86 74.61 22.1 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.155 179.899 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.1 117.0 1.96 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.782 2.321 . . . . 0.0 112.46 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 421' ' ' VAL . . . . . 0.516 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.2 t -74.34 97.84 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.199 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.5 21.84 8.99 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.61 0.719 . . . . 0.0 109.386 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 423' ' ' GLY . . . . . 0.555 ' HA2' HG21 ' B' ' 426' ' ' VAL . . . 102.31 29.21 6.1 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.273 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 424' ' ' VAL . . . . . 0.516 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.42 -37.57 31.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.86 35.92 4.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.331 . . . . 0.0 111.825 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 426' ' ' VAL . . . . . 0.652 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.41 -44.59 46.65 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.827 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 427' ' ' PRO . . . . . 0.652 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.8 Cg_endo -66.3 77.07 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.516 2.144 . . . . 0.0 111.113 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.34 -15.47 3.2 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.338 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.53 149.37 50.25 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.591 0.234 . . . . 0.0 110.793 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.54 -14.24 5.05 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.856 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 126.16 44.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.833 0.349 . . . . 0.0 111.028 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 432' ' ' ILE . . . . . 0.649 HG21 ' HD2' ' B' ' 418' ' ' PRO . 7.8 pt -131.03 172.89 15.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.243 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 433' ' ' PHE . . . . . 0.578 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.3 2.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.989 0.423 . . . . 0.0 111.974 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 434' ' ' VAL . . . . . 0.568 HG11 HG22 ' B' ' 415' ' ' ILE . 3.3 m -135.88 141.71 41.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.207 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 435' ' ' GLU . . . . . 0.475 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.3 108.49 17.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.819 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.79 168.36 12.53 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.227 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 437' ' ' THR . . . . . 0.602 HG21 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.93 -45.39 7.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.438 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.91 146.66 52.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.096 0.474 . . . . 0.0 111.215 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.25 -12.7 16.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.263 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.87 25.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.082 0.468 . . . . 0.0 110.088 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.16 -29.37 60.43 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.864 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 442' ' ' CYS . . . . . 0.547 ' HB3' ' HH ' ' B' ' 463' ' ' TYR . 0.3 OUTLIER -62.32 -31.68 72.32 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.168 179.241 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.64 -48.06 15.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.649 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.08 59.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.719 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -55.6 3.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.993 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 446' ' ' MET . . . . . . . . . . . . . 3.4 ptm -64.14 -26.98 68.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.178 -179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.16 -16.25 63.06 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.625 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.51 22.7 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.415 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 449' ' ' LEU . . . . . 0.632 ' HB2' HG21 ' B' ' 461' ' ' THR . 97.2 mt -95.72 -20.55 18.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.797 0.332 . . . . 0.0 110.894 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 3.3 t -72.59 131.72 42.83 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.899 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.98 -9.81 72.53 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.157 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -77.11 -152.22 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 117.239 0.52 . . . . 0.0 110.587 178.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 453' ' ' LYS . . . . . 0.746 ' HZ2' HG23 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -160.83 117.08 2.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.853 0.358 . . . . 0.0 111.285 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.23 -36.43 75.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.524 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.16 -50.92 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.814 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.23 24.86 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.761 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 457' ' ' ARG . . . . . 0.409 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.38 134.77 18.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.344 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 2.8 m -59.65 138.42 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-O 121.042 0.449 . . . . 0.0 111.62 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 57.5 t -98.73 115.79 40.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.419 -176.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 460' ' ' VAL . . . . . 0.809 HG11 ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -82.81 114.5 23.75 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.796 174.385 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 461' ' ' THR . . . . . 0.632 HG21 ' HB2' ' B' ' 449' ' ' LEU . 14.1 p -100.96 132.14 46.51 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.139 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 462' ' ' LYS . . . . . 0.416 ' HE3' ' HB2' ' B' ' 462' ' ' LYS . 0.0 OUTLIER -127.46 -175.74 3.54 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.727 0.775 . . . . 0.0 111.455 -177.045 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 463' ' ' TYR . . . . . 0.547 ' HH ' ' HB3' ' B' ' 442' ' ' CYS . 1.2 m-85 -111.54 146.9 36.5 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.473 172.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 464' ' ' CYS . . . . . 0.447 ' O ' HG23 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 149.03 47.47 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.992 0.425 . . . . 0.0 111.431 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 465' ' ' ASP . . . . . 0.441 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.46 129.36 66.37 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.374 -179.812 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 466' ' ' PRO . . . . . 0.48 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -53.98 -33.31 72.16 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.76 2.307 . . . . 0.0 112.127 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -58.49 7.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.399 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.44 -33.72 68.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.278 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 469' ' ' TYR . . . . . 0.475 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.03 -51.23 70.54 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.203 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.36 -47.6 69.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.291 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 471' ' ' ARG . . . . . 0.462 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.67 -2.19 49.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.383 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.78 8.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 0.0 110.234 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 473' ' ' ASP . . . . . 0.462 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.66 -20.45 21.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.951 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 11.5 p90 56.29 19.29 3.85 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.82 1.248 . . . . 0.0 112.771 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.828 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.8 tpp . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.808 0.337 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -119.24 97.65 5.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.931 178.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.0 t -91.78 131.25 37.28 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.042 0.449 . . . . 0.0 111.248 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -136.96 -44.39 0.09 OUTLIER Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.599 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -87.16 -16.02 36.64 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.503 0.192 . . . . 0.0 111.106 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 65.02 -172.57 0.18 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.686 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -104.68 -21.35 13.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.593 178.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.2 t -127.15 132.33 24.27 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.082 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -66.61 142.9 66.31 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.857 2.371 . . . . 0.0 112.09 176.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.8 mp -74.61 109.93 8.49 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.878 0.37 . . . . 0.0 111.107 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -152.06 119.6 6.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.633 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -95.33 151.49 38.71 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.948 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.28 115.57 2.57 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.936 2.424 . . . . 0.0 112.25 172.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.02 -166.75 1.32 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.859 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.91 12.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.878 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.3 -36.29 3.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.043 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.76 91.89 2.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.855 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.9 -54.33 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.786 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.82 111.24 13.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.01 125.63 25.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.787 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.59 12.78 19.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.976 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.519 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.4 m95 -141.97 53.08 1.48 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.791 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -156.58 0.13 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.854 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.47 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.33 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.927 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.73 120.36 39.81 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.609 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.995 ' HB ' HG21 ' A' ' 32' ' ' VAL . 2.9 m -145.78 147.4 31.83 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 123.655 0.597 . . . . 0.0 110.782 -177.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.589 ' HG3' ' HG3' ' A' ' 28' ' ' GLU . 9.7 tpt -123.94 130.64 52.91 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.495 -177.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.589 ' HG3' ' HG3' ' A' ' 27' ' ' MET . 48.3 mt-10 75.3 -32.09 0.21 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 174.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -81.59 96.34 7.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.728 0.299 . . . . 0.0 111.262 -177.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? 64.21 -176.04 0.16 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.846 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 37.9 p -89.52 106.09 18.23 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.073 0.463 . . . . 0.0 111.035 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.995 HG21 ' HB ' ' A' ' 26' ' ' THR . 48.6 t -106.01 103.28 15.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.73 -174.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.63 ' HB ' ' HZ1' ' A' ' 64' ' ' LYS . 2.2 tp -111.33 104.63 56.36 Favored Pre-proline 0 CA--C 1.54 0.561 0 CA-C-O 121.014 0.435 . . . . 0.0 111.618 176.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -67.17 144.3 68.4 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.966 2.444 . . . . 0.0 112.056 176.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -134.88 -143.98 4.91 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.3 -0.952 . . . . 0.0 113.605 -177.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.818 ' HB3' ' HD2' ' A' ' 37' ' ' PRO . 64.9 mtt -130.9 -177.93 0.75 Allowed Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 122.788 0.435 . . . . 0.0 110.18 -175.297 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.818 ' HD2' ' HB3' ' A' ' 36' ' ' MET . 1.2 Cg_endo -45.22 146.5 2.85 Favored 'Trans proline' 0 C--N 1.365 1.403 0 C-N-CA 122.911 2.408 . . . . 0.0 112.399 172.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.698 ' HG1' ' HA ' ' B' ' 460' ' ' VAL . 16.6 p -131.46 45.41 2.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.674 -169.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.9 m -95.15 112.04 26.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.661 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.816 ' H ' ' HG2' ' B' ' 462' ' ' LYS . 0.4 OUTLIER -80.12 136.79 53.42 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-O 120.883 0.373 . . . . 0.0 110.915 -175.611 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 40' ' ' ILE . 8.0 Cg_exo -73.99 127.67 11.63 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.165 2.576 . . . . 0.0 112.321 178.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.763 ' HG2' ' HD1' ' B' ' 373' ' ' HIS . 31.6 Cg_exo -60.48 154.33 54.49 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.119 2.546 . . . . 0.0 112.812 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 85.57 50.16 4.1 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.944 -0.646 . . . . 0.0 111.491 -175.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -143.62 163.53 32.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.942 0.401 . . . . 0.0 111.665 -173.454 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.517 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 23.3 p -106.08 163.43 12.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.178 178.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.406 ' HD3' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -60.98 -31.39 70.98 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.337 -176.504 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.517 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.32 -45.17 61.13 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.11 -33.44 73.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.762 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.499 ' HB2' HD22 ' A' ' 44' ' ' LEU . 41.6 tt0 -58.89 -46.49 87.73 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.344 177.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.466 ' O ' HG22 ' A' ' 54' ' ' VAL . 16.0 mmt180 -63.21 -43.36 98.34 Favored 'General case' 0 C--O 1.185 -2.304 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.267 177.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.461 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.45 -42.15 86.74 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 123.739 0.649 . . . . 0.0 111.58 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -64.31 -44.98 89.91 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.162 176.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.43 HD13 ' HA ' ' A' ' 53' ' ' ILE . 8.6 mm -71.5 -41.73 72.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.319 -179.273 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -67.21 -35.64 74.66 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.768 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.835 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.01 -43.32 91.52 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 118.558 0.617 . . . . 0.0 110.277 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.581 ' HG ' ' N ' ' A' ' 57' ' ' GLN . 0.1 OUTLIER -63.23 -41.91 99.16 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.776 176.817 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.581 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 52.0 mt-30 -72.51 -31.27 65.2 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.742 178.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 54' ' ' VAL . 73.3 mt -64.51 -47.0 91.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 123.147 0.279 . . . . 0.0 110.447 176.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.46 -41.39 84.76 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.231 -0.588 . . . . 0.0 110.701 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.465 ' OD2' HD11 ' A' ' 56' ' ' LEU . 69.3 m-20 -69.1 -33.61 73.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.176 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.532 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -65.92 -45.0 83.52 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 173.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 m -65.51 -35.73 81.73 Favored 'General case' 0 N--CA 1.433 -1.321 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.443 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.84 -42.75 76.23 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 122.055 0.931 . . . . 0.0 108.505 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.63 ' HZ1' ' HB ' ' A' ' 33' ' ' ILE . 22.1 ttmt -61.85 -47.72 83.75 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 113.837 -1.528 . . . . 0.0 111.871 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.23 -28.84 63.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.818 177.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -67.95 -47.17 69.39 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.443 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.48 14.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.916 -0.714 . . . . 0.0 112.858 -177.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.78 29.41 10.73 Favored Glycine 0 C--N 1.316 -0.575 0 C-N-CA 119.809 -1.186 . . . . 0.0 111.267 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.43 92.11 6.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.227 0.537 . . . . 0.0 110.138 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.2 tp -102.22 -51.99 3.24 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.817 0.341 . . . . 0.0 111.024 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -158.78 -66.82 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.589 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.412 HG12 ' HB2' ' A' ' 27' ' ' MET . 49.3 mm -105.97 114.36 62.72 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.681 0.277 . . . . 0.0 111.146 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.429 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 58.3 Cg_endo -72.38 145.28 42.7 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.672 2.248 . . . . 0.0 111.896 175.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 73' ' ' PRO . 31.9 Cg_exo -59.32 132.72 48.12 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.874 2.382 . . . . 0.0 112.714 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -78.61 151.45 77.23 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.941 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.11 -2.41 11.55 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 123.112 2.541 . . . . 0.0 112.856 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.44 131.04 35.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.717 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -80.15 116.49 20.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.699 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.6 ptp85 -128.25 168.79 14.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.502 -176.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 33.3 t 65.15 94.62 0.05 OUTLIER Pre-proline 0 N--CA 1.469 0.486 0 CA-C-N 115.384 -0.825 . . . . 0.0 112.058 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.29 128.33 11.97 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.689 2.259 . . . . 0.0 111.644 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 23.1 t -151.88 133.76 8.28 Favored Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.972 -178.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.04 -49.36 2.11 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.76 2.307 . . . . 0.0 112.187 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -119.2 126.4 27.06 Favored Pre-proline 0 CA--C 1.53 0.209 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.436 177.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.13 95.33 0.91 Allowed 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.74 2.293 . . . . 0.0 113.335 -177.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 pt -102.07 106.58 20.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.365 174.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -97.06 -54.36 3.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.52 -172.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.499 HD21 ' H ' ' A' ' 90' ' ' GLU . 2.0 p-10 -72.16 179.32 3.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.018 0.437 . . . . 0.0 111.977 -173.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 55.6 m -69.24 -19.62 63.95 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.706 -177.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.499 ' H ' HD21 ' A' ' 88' ' ' ASN . 35.5 mt-10 66.75 -171.02 0.19 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.535 0.522 . . . . 0.0 111.54 177.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 79.12 -118.99 4.92 Favored Glycine 0 C--N 1.331 0.26 0 C-N-CA 121.072 -0.585 . . . . 0.0 112.786 178.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.7 pttm -110.06 -57.28 2.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.571 0.224 . . . . 0.0 111.123 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -98.86 103.12 15.04 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.991 0.424 . . . . 0.0 110.809 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 pp -93.74 -12.57 28.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.662 178.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -100.61 94.06 5.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.263 0.554 . . . . 0.0 111.06 -179.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -153.39 -50.19 0.1 Allowed 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.707 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.23 -52.44 16.41 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.191 -0.943 . . . . 0.0 109.603 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -53.33 -51.75 61.37 Favored 'General case' 0 CA--C 1.503 -0.836 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.629 -178.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.62 -38.71 87.5 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 113.417 -1.719 . . . . 0.0 110.686 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.508 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.99 -44.45 94.5 Favored 'General case' 0 CA--C 1.511 -0.528 0 O-C-N 123.209 0.318 . . . . 0.0 110.363 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.702 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.4 m -68.99 -50.08 52.11 Favored 'General case' 0 N--CA 1.428 -1.54 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.629 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.429 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.44 -41.32 93.61 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -175.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.02 -39.1 89.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.547 0.213 . . . . 0.0 110.432 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.519 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.22 -40.15 89.13 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.7 mt -63.99 -41.02 97.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.641 178.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.429 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.06 -34.39 78.3 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.798 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.4 -34.36 74.37 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 177.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.46 -48.76 76.36 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 175.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.53 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.37 -45.41 94.49 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.405 179.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.28 -37.47 85.65 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.939 -178.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.76 -43.81 85.7 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.5 mt -72.17 -38.58 69.1 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.749 177.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.0 mm -57.49 -50.79 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 110.507 -0.182 . . . . 0.0 110.507 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.9 m -60.84 -39.37 88.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.212 0.529 . . . . 0.0 110.523 -179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.597 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -68.0 -49.59 60.66 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.02 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.3 -37.21 84.88 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.5 t -65.41 -36.9 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-O 121.171 0.51 . . . . 0.0 109.657 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.69 -40.69 79.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.2 0.524 . . . . 0.0 110.238 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.0 mt -71.41 -40.56 70.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.118 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.66 111.14 12.43 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.957 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.73 -22.64 36.97 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.78 2.32 . . . . 0.0 112.545 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.38 0.23 55.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.337 0.589 . . . . 0.0 111.151 -177.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -65.02 134.63 54.29 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.623 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.34 109.17 62.91 Favored Pre-proline 0 CA--C 1.509 -0.622 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.276 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -68.31 157.97 59.53 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.317 2.011 . . . . 0.0 111.456 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.69 154.44 25.73 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 123.634 2.889 . . . . 0.0 111.711 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.95 -30.41 69.7 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -173.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -85.54 3.49 40.31 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 123.716 0.635 . . . . 0.0 111.481 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -69.71 127.42 32.89 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.875 0.369 . . . . 0.0 110.644 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -103.55 125.81 33.82 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.701 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . 0.407 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 37.2 Cg_endo -66.13 151.47 83.6 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.625 2.216 . . . . 0.0 112.474 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 31.2 Cg_exo -60.03 135.35 62.17 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.003 2.469 . . . . 0.0 112.566 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -106.32 -44.95 4.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.622 -177.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.4 m -86.73 113.0 22.21 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.955 0.407 . . . . 0.0 111.493 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.9 mtm180 -118.57 119.2 33.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.417 177.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 9.6 p -102.94 139.78 22.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.142 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 26.9 p -139.43 158.8 43.51 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.073 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -112.87 140.86 47.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.87 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -148.55 118.69 7.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.606 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.5 p -151.91 130.55 2.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.429 175.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 22.1 ptm -123.8 167.83 13.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.037 0.446 . . . . 0.0 111.73 -176.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 66.6 mt -112.51 114.94 49.82 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 177.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.29 158.03 57.53 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.73 2.286 . . . . 0.0 113.007 -177.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -86.02 160.01 19.44 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.869 179.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.159 -0.924 . . . . 0.0 110.852 -179.901 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.224 0 N-CA-C 112.662 -0.175 . . . . 0.0 112.662 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 373' ' ' HIS . . . . . 0.763 ' HD1' ' HG2' ' A' ' 42' ' ' PRO . 32.2 m80 -119.78 114.93 33.82 Favored Pre-proline 0 C--N 1.332 -0.19 0 CA-C-O 120.503 0.192 . . . . 0.0 111.148 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.95 134.65 44.15 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.866 2.378 . . . . 0.0 111.699 175.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 375' ' ' THR . . . . . 0.447 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -126.29 -71.35 0.69 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.165 -174.72 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 376' ' ' GLU . . . . . 0.482 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.9 0.01 OUTLIER 'General case' 0 C--O 1.231 0.095 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 377' ' ' VAL . . . . . 0.452 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.7 150.89 8.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.458 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 378' ' ' LEU . . . . . 0.534 HD23 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.57 152.53 20.86 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.276 -179.078 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 379' ' ' CYS . . . . . 0.576 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.49 142.53 46.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.684 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . 0.429 HD11 HG12 ' B' ' 434' ' ' VAL . 5.3 mt -132.71 101.84 5.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.953 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 2.6 tmm? -117.86 166.49 12.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.45 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 382' ' ' ASN . . . . . 0.439 HD22 ' NE2' ' A' ' 57' ' ' GLN . 13.2 t30 57.8 51.18 9.52 Favored 'General case' 0 CA--C 1.528 0.105 0 O-C-N 123.599 0.562 . . . . 0.0 111.415 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 383' ' ' MET . . . . . 0.803 ' HB3' HG11 ' B' ' 459' ' ' VAL . 3.0 ptm -164.85 14.33 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.236 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 384' ' ' VAL . . . . . 0.464 HG12 HD13 ' B' ' 398' ' ' ILE . 0.4 OUTLIER -152.27 125.17 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.86 0.362 . . . . 0.0 111.308 179.876 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . . . . . . . . . 20.1 mt -110.72 151.76 43.05 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.396 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.16 -23.47 73.05 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.286 1.991 . . . . 0.0 112.294 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.91 -5.52 53.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.45 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.69 5.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.928 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 389' ' ' LEU . . . . . 0.458 HD12 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.595 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 390' ' ' LEU . . . . . 0.523 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.62 -15.69 5.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.605 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.3 148.83 23.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.606 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -73.64 -30.23 62.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.16 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.33 -47.61 26.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.997 0.427 . . . . 0.0 110.833 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.59 -44.23 91.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.841 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.37 -59.43 4.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.181 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -27.25 61.5 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.196 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.2 -41.05 67.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.401 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 398' ' ' ILE . . . . . 0.464 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.83 -53.65 16.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.542 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 399' ' ' VAL . . . . . 0.558 HG23 HD13 ' B' ' 417' ' ' ILE . 59.7 t -53.32 -46.91 58.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.817 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.5 -59.94 3.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.526 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.67 -57.14 11.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.369 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.13 -32.88 15.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.303 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 403' ' ' ARG . . . . . 0.454 ' HA ' HD13 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.19 -57.36 4.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.751 0.31 . . . . 0.0 111.166 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.92 -33.66 64.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.171 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 405' ' ' GLU . . . . . 0.519 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.43 -47.1 44.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.83 -23.96 67.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.13 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.14 30.28 1.12 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.932 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.08 -17.06 12.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.74 -15.45 14.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.558 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.19 -139.45 4.15 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.573 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.24 132.46 56.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.697 0.284 . . . . 0.0 111.113 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.39 115.48 48.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.012 0.434 . . . . 0.0 110.543 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . 0.611 ' HG3' HG23 ' B' ' 437' ' ' THR . 10.9 mttt -56.6 -61.96 2.06 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.248 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.04 -169.43 3.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.103 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 415' ' ' ILE . . . . . 0.59 HG23 HG13 ' B' ' 434' ' ' VAL . 48.3 mt -145.05 128.96 12.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.849 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 416' ' ' GLU . . . . . 0.408 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.91 108.84 18.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.702 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 417' ' ' ILE . . . . . 0.603 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.7 mt -128.52 108.62 19.07 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.637 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 418' ' ' PRO . . . . . 0.633 ' HD2' HG23 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.49 147.56 9.0 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.709 2.273 . . . . 0.0 112.87 -179.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 419' ' ' ARG . . . . . 0.523 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.89 74.64 21.97 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.194 179.875 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -47.14 117.04 1.99 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.739 2.293 . . . . 0.0 112.504 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 421' ' ' VAL . . . . . 0.512 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.7 t -74.28 97.8 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.22 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.57 21.74 8.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.482 0.658 . . . . 0.0 109.348 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 423' ' ' GLY . . . . . 0.554 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.4 29.21 6.07 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.263 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 424' ' ' VAL . . . . . 0.512 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.45 -37.59 30.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.119 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.83 35.9 4.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.844 0.355 . . . . 0.0 111.849 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 426' ' ' VAL . . . . . 0.65 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.22 -44.75 49.35 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.839 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 427' ' ' PRO . . . . . 0.65 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.1 Cg_endo -66.33 77.16 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.537 2.158 . . . . 0.0 111.018 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.21 -15.43 3.23 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.367 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.5 149.37 50.26 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.615 0.245 . . . . 0.0 110.79 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.15 5.06 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.838 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.52 126.1 44.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.899 0.38 . . . . 0.0 111.0 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 432' ' ' ILE . . . . . 0.633 HG23 ' HD2' ' B' ' 418' ' ' PRO . 7.9 pt -130.98 172.92 15.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.256 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 433' ' ' PHE . . . . . 0.576 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.34 2.79 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.954 -178.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 434' ' ' VAL . . . . . 0.59 HG13 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.85 141.73 41.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.188 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 435' ' ' GLU . . . . . 0.476 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.41 108.53 17.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.752 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.83 168.39 12.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.256 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 437' ' ' THR . . . . . 0.611 HG23 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -94.97 -45.4 7.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.451 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.87 146.67 52.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.07 0.462 . . . . 0.0 111.26 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.21 -12.77 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.165 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.62 -54.8 26.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.09 0.471 . . . . 0.0 110.096 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.14 -29.52 60.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.818 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 442' ' ' CYS . . . . . 0.565 ' HB3' ' HH ' ' B' ' 463' ' ' TYR . 0.3 OUTLIER -62.22 -31.68 72.26 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.22 179.246 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.66 -48.0 15.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.682 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.62 -12.03 59.52 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.738 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -55.28 3.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.949 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 446' ' ' MET . . . . . 0.534 ' HB3' HD23 ' B' ' 378' ' ' LEU . 0.2 OUTLIER -64.83 -26.6 68.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.199 -179.313 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.16 -16.2 63.06 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.588 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.62 -8.63 22.52 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.354 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.3 mt -95.69 -20.76 18.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.726 0.298 . . . . 0.0 110.898 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 15.8 p -73.95 126.73 31.1 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.063 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 98.35 -9.06 62.77 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.978 178.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -76.59 -152.21 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.787 0.293 . . . . 0.0 110.505 177.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 453' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.1 2.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.768 0.318 . . . . 0.0 111.296 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.35 -36.29 75.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.515 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.26 -50.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.3 24.86 0.3 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.779 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 457' ' ' ARG . . . . . 0.415 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.52 135.74 19.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.316 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 13.4 p -59.41 126.94 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 121.273 0.559 . . . . 0.0 111.034 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 459' ' ' VAL . . . . . 0.803 HG11 ' HB3' ' B' ' 383' ' ' MET . 3.7 m -84.86 127.82 39.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.844 -176.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 460' ' ' VAL . . . . . 0.698 ' HA ' ' HG1' ' A' ' 38' ' ' THR . 47.0 t -95.45 92.55 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.063 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 67.5 p -100.25 128.01 46.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.907 0.384 . . . . 0.0 111.316 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 462' ' ' LYS . . . . . 0.816 ' HG2' ' H ' ' A' ' 40' ' ' ILE . 11.7 mtmt -132.02 -159.67 0.98 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.038 -178.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 463' ' ' TYR . . . . . 0.565 ' HH ' ' HB3' ' B' ' 442' ' ' CYS . 1.2 m-85 -113.32 147.02 38.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.53 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 464' ' ' CYS . . . . . 0.452 ' O ' HG21 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.88 149.0 47.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.049 0.452 . . . . 0.0 111.311 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 465' ' ' ASP . . . . . 0.447 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.33 129.34 66.86 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.405 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 466' ' ' PRO . . . . . 0.482 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.09 -33.21 72.88 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.708 2.272 . . . . 0.0 112.095 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.06 -58.55 7.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.37 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.33 -33.81 68.11 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.291 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 469' ' ' TYR . . . . . 0.476 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.5 t80 -60.12 -51.18 70.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.162 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.42 -47.5 69.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.326 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 471' ' ' ARG . . . . . 0.463 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.17 49.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.39 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.11 20.8 8.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.888 0.375 . . . . 0.0 110.215 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 473' ' ' ASP . . . . . 0.463 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.72 -20.94 24.56 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.978 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -87.47 75.45 9.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.23 0.538 . . . . 0.0 110.541 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 3.3 p-90 . . . . . 0 C--O 1.246 0.917 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.397 178.391 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.9 mtp . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.803 0.335 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -117.27 -29.07 5.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.462 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 11.4 t -145.42 160.95 40.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.801 0.334 . . . . 0.0 111.324 -177.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.81 -0.01 86.16 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.632 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -73.69 147.77 43.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.771 0.32 . . . . 0.0 110.948 178.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -85.77 89.95 7.9 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.032 0.444 . . . . 0.0 111.578 -177.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.99 -28.61 18.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.025 174.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.465 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 30.2 p -93.66 127.32 46.37 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.637 176.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 16.2 Cg_exo -69.02 162.85 39.98 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.131 2.554 . . . . 0.0 112.709 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.427 ' HA ' HD13 ' A' ' 10' ' ' LEU . 3.6 mm? -63.96 -24.81 67.86 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.096 176.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -83.41 125.84 32.11 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.733 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -100.96 155.24 36.54 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.545 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.77 115.49 2.52 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.664 2.243 . . . . 0.0 112.384 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.98 -166.76 1.33 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.904 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.34 51.97 12.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.41 -36.15 3.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.002 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.79 91.85 2.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.863 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.93 -54.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.799 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.87 111.13 13.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.005 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.93 125.69 25.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.735 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.67 12.73 19.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.961 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.589 ' HZ3' HG13 ' B' ' 459' ' ' VAL . 71.6 m95 -141.97 52.97 1.48 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.766 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.15 -156.59 0.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.928 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.464 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.3 -37.65 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.76 121.26 42.76 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 118.951 -0.547 . . . . 0.0 110.64 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.581 ' HB ' ' HA3' ' A' ' 71' ' ' GLY . 59.3 p -118.25 175.88 5.49 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 123.266 0.353 . . . . 0.0 110.904 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 4.8 tpt 53.17 -96.86 0.06 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.698 0.623 . . . . 0.0 112.323 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -97.48 135.32 39.51 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.273 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -97.72 99.83 11.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.154 175.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -111.85 -67.13 1.02 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.633 -176.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.9 t -125.35 138.88 54.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.238 0.542 . . . . 0.0 111.901 -176.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -112.97 94.1 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.844 175.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.95 123.35 30.31 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 121.297 0.57 . . . . 0.0 111.398 -176.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -78.11 118.21 4.32 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.691 2.26 . . . . 0.0 112.596 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 161.27 56.21 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.935 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.1 ptm -134.72 74.16 65.47 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.08 0.467 . . . . 0.0 110.749 177.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -81.41 142.46 13.21 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 123.215 2.61 . . . . 0.0 112.265 -178.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.576 ' HB ' HG22 ' B' ' 460' ' ' VAL . 15.4 p -115.84 -25.04 7.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.979 -178.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 22.1 m -60.69 125.98 17.77 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-O 121.388 0.613 . . . . 0.0 111.659 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.626 ' H ' ' HZ1' ' B' ' 462' ' ' LYS . 0.5 OUTLIER -79.39 132.87 61.1 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.992 -177.939 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.43 ' O ' HD23 ' A' ' 44' ' ' LEU . 54.5 Cg_endo -71.49 132.88 21.36 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.024 2.483 . . . . 0.0 112.744 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 29.8 Cg_exo -62.0 125.75 17.22 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.965 2.444 . . . . 0.0 112.642 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 114.45 50.98 0.48 Allowed Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.575 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.43 HD23 ' O ' ' A' ' 41' ' ' PRO . 1.5 pt? -152.45 -169.01 3.22 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.72 0.295 . . . . 0.0 110.968 -179.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.593 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 40.3 p -119.35 170.04 9.47 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.493 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.402 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.0 -31.32 71.68 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.297 178.74 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.593 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.32 -44.99 61.89 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.441 ' H ' ' HG1' ' A' ' 45' ' ' THR . 5.2 tp-100 -69.43 -33.27 72.72 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.631 -176.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.486 ' HG3' ' CD1' ' A' ' 40' ' ' ILE . 22.4 tt0 -57.8 -48.23 80.3 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.095 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.439 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.62 -43.41 98.88 Favored 'General case' 0 C--O 1.186 -2.285 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.236 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.451 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.44 -40.08 81.57 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.782 0.676 . . . . 0.0 111.557 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -67.57 -45.79 74.55 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.021 175.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.599 HG23 HG23 ' B' ' 460' ' ' VAL . 95.8 mt -61.68 -49.14 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 177.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' A' ' 51' ' ' ALA . 34.9 m -67.51 -35.54 73.55 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.776 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.916 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.15 -44.58 92.09 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.568 0.622 . . . . 0.0 110.319 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.5 tp -65.29 -35.36 80.77 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.976 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -75.12 -34.6 61.71 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.656 176.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.473 HD12 HD13 ' A' ' 113' ' ' ILE . 72.8 mt -63.05 -46.91 94.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.401 0.68 . . . . 0.0 110.433 177.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.41 -41.39 84.94 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.668 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -67.68 -34.01 76.06 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.404 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.523 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.48 -45.02 77.12 Favored 'General case' 0 C--O 1.207 -1.181 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 174.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.1 m -65.43 -35.86 82.2 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.446 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.8 -42.73 76.04 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.054 0.931 . . . . 0.0 108.529 176.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.523 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.84 -47.77 83.59 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 113.833 -1.53 . . . . 0.0 111.871 179.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.17 -28.92 63.54 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.758 177.093 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.91 -47.16 69.53 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.09 -17.52 14.46 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.75 29.47 10.68 Favored Glycine 0 C--N 1.315 -0.605 0 C-N-CA 119.858 -1.163 . . . . 0.0 111.259 -177.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.4 92.07 6.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.185 0.517 . . . . 0.0 110.165 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 18.3 tp -105.73 -50.82 3.11 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.503 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.581 ' HA3' ' HB ' ' A' ' 26' ' ' THR . . . 79.48 -96.61 1.52 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.227 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.485 HD13 HD21 ' B' ' 456' ' ' ASN . 17.8 pt -84.16 135.97 41.32 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.789 0.328 . . . . 0.0 110.794 177.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.97 162.57 41.1 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.794 2.33 . . . . 0.0 112.505 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.84 -2.34 10.07 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.762 2.308 . . . . 0.0 112.741 177.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -73.88 144.84 83.2 Favored Pre-proline 0 C--O 1.232 0.183 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.767 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.84 -50.53 10.13 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.049 2.499 . . . . 0.0 112.682 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -151.2 99.94 2.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.005 0.431 . . . . 0.0 110.657 178.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -100.4 108.77 20.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.083 177.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -87.79 -54.39 4.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.043 -177.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.419 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 70.3 m -134.09 141.69 40.48 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.204 -178.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 80' ' ' SER . 23.9 Cg_exo -65.68 153.69 77.06 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.215 2.61 . . . . 0.0 112.716 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 63.5 m -85.99 139.83 34.88 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.294 -178.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -80.53 173.82 11.88 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.838 2.359 . . . . 0.0 112.555 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -151.29 111.41 3.03 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.562 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -69.53 -33.45 17.41 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.764 2.309 . . . . 0.0 113.314 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 11.2 tt -106.96 127.6 62.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-O 121.201 0.524 . . . . 0.0 111.699 -178.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 37.6 p90 -103.75 149.75 24.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.467 177.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -134.3 113.16 11.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.145 0.497 . . . . 0.0 111.112 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 36.3 t -74.68 -34.49 62.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.329 176.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -126.45 124.98 41.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.541 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 169.95 23.89 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.93 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.2 mmtp -129.88 126.79 38.8 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.028 0.442 . . . . 0.0 111.25 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -136.18 -50.97 0.7 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.39 179.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 33.3 mt -101.97 146.2 28.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.759 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -86.29 160.13 19.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.271 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.2 t -168.51 -50.13 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -177.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.19 -52.43 16.55 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.329 -0.857 . . . . 0.0 109.693 -178.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.5 mp0 -53.27 -51.83 60.98 Favored 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 113.655 -1.611 . . . . 0.0 110.633 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -66.67 -38.64 87.24 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.686 -177.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.511 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.96 -44.46 94.42 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 123.197 0.311 . . . . 0.0 110.385 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.695 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.9 m -69.06 -50.04 51.98 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.617 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.4 -41.28 93.82 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.95 -39.23 90.27 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 178.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.521 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.27 -40.06 89.04 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.4 mt -64.07 -40.94 97.37 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.648 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.12 -34.3 78.08 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.75 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.5 -34.39 74.23 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.4 -48.81 76.29 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.549 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.3 -45.55 94.01 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.39 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.14 -37.47 85.31 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 123.594 0.758 . . . . 0.0 111.004 -178.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.85 -43.76 86.13 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.4 mt -72.23 -38.57 68.92 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.773 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.549 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.38 -50.9 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 N-CA-C 110.514 -0.18 . . . . 0.0 110.514 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.7 m -60.71 -39.46 88.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.276 0.56 . . . . 0.0 110.551 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -68.0 -49.51 61.16 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.97 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.11 84.49 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -177.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.63 -36.85 78.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.53 -40.72 80.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.257 0.551 . . . . 0.0 110.299 177.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.5 mt -71.52 -40.6 70.0 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.982 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.64 111.23 12.47 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 116.3 -0.409 . . . . 0.0 109.929 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.78 -22.61 36.66 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.779 2.319 . . . . 0.0 112.62 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.29 0.06 55.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.409 0.623 . . . . 0.0 111.179 -177.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.91 134.64 54.42 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.606 -178.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.39 109.13 62.86 Favored Pre-proline 0 CA--C 1.509 -0.619 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.278 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.31 157.95 59.65 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.306 2.004 . . . . 0.0 111.507 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.67 154.52 25.35 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 123.589 2.859 . . . . 0.0 111.724 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.11 70.57 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -173.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -86.15 32.89 0.61 Allowed 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.765 0.666 . . . . 0.0 111.626 -177.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . 0.769 ' HH ' HH11 ' A' ' 135' ' ' ARG . 9.3 p90 -86.31 149.45 25.04 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.591 177.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -126.97 115.82 22.06 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 177.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -68.35 158.86 55.8 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.855 2.37 . . . . 0.0 112.1 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -56.57 -62.43 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.901 2.401 . . . . 0.0 112.216 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -125.23 -52.65 1.63 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.085 175.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 14.8 t -164.35 155.61 15.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.209 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.769 HH11 ' HH ' ' A' ' 129' ' ' TYR . 12.1 mtp180 -70.04 133.68 47.46 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.907 0.384 . . . . 0.0 110.746 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 12.8 t -69.32 127.23 30.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.142 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 73.2 m 61.42 46.63 7.43 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.354 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -123.46 -15.43 7.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.618 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 7.4 ttpm? -119.03 -29.94 5.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.824 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 8.4 p -79.7 143.16 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.07 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 4.3 mpp? -94.41 169.84 9.92 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.272 -178.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.458 ' HB ' ' HD2' ' A' ' 143' ' ' PRO . 28.5 pt -94.43 159.84 32.99 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.155 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.458 ' HD2' ' HB ' ' A' ' 142' ' ' ILE . 27.9 Cg_endo -62.95 138.87 70.61 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.694 2.262 . . . . 0.0 112.237 178.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -89.47 155.76 19.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.92 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.427 -0.797 . . . . 0.0 110.986 -178.878 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.194 0 N-CA-C 112.571 -0.211 . . . . 0.0 112.571 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -122.05 101.1 42.13 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-O 120.709 0.29 . . . . 0.0 111.031 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.34 148.08 23.51 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.678 2.252 . . . . 0.0 112.696 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 375' ' ' THR . . . . . 0.45 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -129.5 -71.32 0.62 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.217 179.161 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 376' ' ' GLU . . . . . 0.481 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.93 0.01 OUTLIER 'General case' 0 C--O 1.232 0.133 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 377' ' ' VAL . . . . . 0.451 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.62 150.99 7.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.402 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 378' ' ' LEU . . . . . 0.501 HD13 ' HG ' ' B' ' 442' ' ' CYS . 0.2 OUTLIER -90.67 152.51 20.82 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.17 -179.085 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 379' ' ' CYS . . . . . 0.554 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.53 142.53 46.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.662 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . 0.42 ' HB3' ' SD ' ' B' ' 383' ' ' MET . 5.4 mt -132.71 101.9 5.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.96 -179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 91.4 mtp -117.36 166.89 11.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.849 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 57.46 51.2 10.08 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 123.649 0.593 . . . . 0.0 111.273 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 383' ' ' MET . . . . . 0.42 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.83 14.4 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.228 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 384' ' ' VAL . . . . . 0.485 HG11 HD13 ' B' ' 398' ' ' ILE . 0.5 OUTLIER -152.25 125.06 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.721 0.296 . . . . 0.0 111.394 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . . . . . . . . . 20.1 mt -110.72 151.77 43.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.431 179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.23 -23.43 72.57 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.351 2.034 . . . . 0.0 112.237 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.95 -5.51 53.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.477 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.73 5.78 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.888 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 389' ' ' LEU . . . . . 0.446 HD13 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.87 34.86 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.932 0.396 . . . . 0.0 110.607 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 390' ' ' LEU . . . . . 0.516 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.51 -15.76 5.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.674 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.29 148.74 23.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.551 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -73.58 -30.27 62.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.168 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 32.8 mm-40 -75.25 -47.76 26.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.998 0.428 . . . . 0.0 110.743 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.54 -44.25 91.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.826 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.37 -59.37 5.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.214 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.29 61.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.203 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.14 -41.02 67.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.402 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 398' ' ' ILE . . . . . 0.485 HD13 HG11 ' B' ' 384' ' ' VAL . 65.4 mt -74.94 -53.69 15.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.474 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 399' ' ' VAL . . . . . 0.564 HG23 HD12 ' B' ' 417' ' ' ILE . 59.5 t -53.22 -46.98 57.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.801 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.92 3.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.517 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.73 -57.16 11.84 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.331 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.1 -32.84 15.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.385 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 403' ' ' ARG . . . . . 0.441 ' HA ' HD12 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.27 -57.39 4.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.12 -179.945 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.92 -33.59 64.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.15 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 405' ' ' GLU . . . . . 0.507 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.41 -47.17 44.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.95 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.78 -24.0 67.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.163 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.45 1.09 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.963 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.18 -17.14 12.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.821 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 409' ' ' TYR . . . . . 0.558 ' HH ' HD21 ' B' ' 449' ' ' LEU . 1.9 m-85 -106.66 -15.47 14.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.489 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.42 4.15 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.571 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 411' ' ' LEU . . . . . 0.422 ' HB3' HG21 ' B' ' 437' ' ' THR . 1.6 mm? -114.24 132.52 56.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.676 0.275 . . . . 0.0 111.052 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.45 115.41 48.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.084 0.469 . . . . 0.0 110.549 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . 0.603 ' HG3' HG23 ' B' ' 437' ' ' THR . 10.9 mttt -56.61 -62.06 1.99 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.168 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.96 -169.38 3.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.167 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 415' ' ' ILE . . . . . 0.571 HG22 HG13 ' B' ' 434' ' ' VAL . 48.5 mt -145.13 128.96 12.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.831 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 416' ' ' GLU . . . . . 0.418 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.9 108.82 18.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.733 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 417' ' ' ILE . . . . . 0.606 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.8 mt -128.55 108.57 19.01 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.644 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 418' ' ' PRO . . . . . 0.673 ' HD2' HG23 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.45 147.61 8.86 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.644 2.229 . . . . 0.0 112.916 -179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 419' ' ' ARG . . . . . 0.516 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.92 74.79 21.71 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.124 179.81 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -47.25 117.06 2.04 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.729 2.286 . . . . 0.0 112.472 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 421' ' ' VAL . . . . . 0.516 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.3 t -74.4 97.86 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.12 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.55 21.71 8.92 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.582 0.706 . . . . 0.0 109.374 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 423' ' ' GLY . . . . . 0.553 ' HA2' HG22 ' B' ' 426' ' ' VAL . . . 102.41 29.23 6.06 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.253 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 424' ' ' VAL . . . . . 0.516 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.48 -37.57 30.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.102 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.86 35.87 4.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.798 0.332 . . . . 0.0 111.809 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 426' ' ' VAL . . . . . 0.657 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.35 -44.68 47.72 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.775 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 427' ' ' PRO . . . . . 0.657 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.27 77.09 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.532 2.155 . . . . 0.0 111.08 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.27 -15.36 3.22 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.349 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.57 149.36 50.22 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.554 0.216 . . . . 0.0 110.864 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.17 5.06 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.842 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.4 126.04 44.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.856 0.36 . . . . 0.0 111.11 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 432' ' ' ILE . . . . . 0.673 HG23 ' HD2' ' B' ' 418' ' ' PRO . 7.8 pt -130.95 172.84 15.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.28 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 433' ' ' PHE . . . . . 0.554 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.43 -176.36 2.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.981 0.419 . . . . 0.0 112.027 -178.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 434' ' ' VAL . . . . . 0.571 HG13 HG22 ' B' ' 415' ' ' ILE . 3.3 m -135.79 141.76 41.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.211 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 435' ' ' GLU . . . . . 0.481 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.36 108.39 17.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.849 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.72 168.4 12.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.255 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 437' ' ' THR . . . . . 0.603 HG23 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.91 -45.44 7.28 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.455 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.87 146.59 52.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.028 0.442 . . . . 0.0 111.249 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.15 -12.74 16.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.238 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -54.79 26.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.015 0.436 . . . . 0.0 110.087 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -75.08 -29.54 60.7 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.829 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 442' ' ' CYS . . . . . 0.51 ' HB3' ' HH ' ' B' ' 463' ' ' TYR . 0.3 OUTLIER -62.2 -31.71 72.27 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.197 179.275 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.61 -48.12 15.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.666 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.55 -12.11 59.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.73 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.83 -55.34 3.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.946 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 446' ' ' MET . . . . . 0.475 ' HE1' ' HA ' ' B' ' 462' ' ' LYS . 3.3 ptm -65.02 -25.86 68.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.22 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.8 -16.2 62.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.606 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.62 22.55 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.418 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 449' ' ' LEU . . . . . 0.558 HD21 ' HH ' ' B' ' 409' ' ' TYR . 97.2 mt -95.66 -19.72 19.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.818 0.342 . . . . 0.0 110.99 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 16.0 m -72.85 125.94 28.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.206 -0.907 . . . . 0.0 111.038 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 98.5 -9.12 62.48 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.946 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -77.83 -152.15 0.05 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.865 0.332 . . . . 0.0 110.553 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 453' ' ' LYS . . . . . 0.464 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.13 2.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.791 0.329 . . . . 0.0 111.263 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.33 -36.33 75.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.55 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.22 -50.92 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.754 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 456' ' ' ASN . . . . . 0.485 HD21 HD13 ' A' ' 72' ' ' ILE . 6.4 p30 -157.23 24.89 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.834 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 457' ' ' ARG . . . . . 0.408 ' NE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.41 132.39 16.19 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.253 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 5.6 p -66.37 112.64 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.552 0.691 . . . . 0.0 110.994 -177.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 459' ' ' VAL . . . . . 0.589 HG13 ' HZ3' ' A' ' 22' ' ' TRP . 1.9 p -73.0 124.03 29.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.736 -174.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 460' ' ' VAL . . . . . 0.599 HG23 HG23 ' A' ' 53' ' ' ILE . 66.9 t -92.55 102.53 13.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.868 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 72.8 p -92.82 153.91 18.57 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.744 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 462' ' ' LYS . . . . . 0.626 ' HZ1' ' H ' ' A' ' 40' ' ' ILE . 0.1 OUTLIER -151.75 -168.41 3.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.082 0.468 . . . . 0.0 111.266 -177.714 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 463' ' ' TYR . . . . . 0.51 ' HH ' ' HB3' ' B' ' 442' ' ' CYS . 1.2 m-85 -112.44 146.91 37.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.411 177.48 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 464' ' ' CYS . . . . . 0.451 ' O ' HG21 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 148.98 47.43 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.071 0.463 . . . . 0.0 111.363 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 465' ' ' ASP . . . . . 0.45 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.32 129.32 66.96 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.377 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 466' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.3 Cg_endo -53.96 -33.32 71.95 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.708 2.272 . . . . 0.0 112.148 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.51 7.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.385 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.81 68.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.289 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 469' ' ' TYR . . . . . 0.481 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.0 -51.28 70.33 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.161 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.38 -47.51 69.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.335 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 471' ' ' ARG . . . . . 0.442 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.68 -2.18 49.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.438 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.1 20.77 8.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.007 0.432 . . . . 0.0 110.282 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 473' ' ' ASP . . . . . 0.442 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.62 -21.82 29.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.96 179.835 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 49.3 p90 43.58 33.48 0.67 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.652 1.181 . . . . 0.0 112.856 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 20.5 t90 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.184 -0.913 . . . . 0.0 110.637 179.572 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.4 mmm . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.88 0.372 . . . . 0.0 110.938 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.89 -25.87 29.85 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.19 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 30.1 p 52.66 -158.6 0.13 Allowed 'General case' 0 N--CA 1.474 0.756 0 O-C-N 123.977 0.798 . . . . 0.0 112.566 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 98.23 77.84 1.36 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.62 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -99.76 52.09 0.92 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.973 0.416 . . . . 0.0 110.825 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.418 HD21 ' HA ' ' A' ' 6' ' ' ASN . 2.7 t-20 -92.55 -42.81 9.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.106 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -135.38 172.85 12.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.845 0.355 . . . . 0.0 111.536 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 25.6 m -106.35 123.6 38.37 Favored Pre-proline 0 CA--C 1.53 0.184 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.883 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 23.4 Cg_exo -64.66 151.97 83.64 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.058 2.506 . . . . 0.0 113.005 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 97.6 mt -112.82 -167.38 1.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.881 179.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -92.96 167.26 11.93 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.319 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -108.5 151.84 41.79 Favored Pre-proline 0 CA--C 1.531 0.223 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.935 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -57.29 115.49 2.54 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.993 2.462 . . . . 0.0 112.407 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.01 -166.7 1.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.836 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.31 51.96 12.22 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.935 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.43 -36.18 3.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.996 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.92 2.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.89 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.93 -54.26 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.734 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.13 13.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.57 24.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.816 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.84 19.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.038 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.581 ' HZ3' HG23 ' B' ' 459' ' ' VAL . 71.7 m95 -142.02 53.05 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.806 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.2 -156.59 0.13 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.889 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.46 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.27 -37.7 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.455 ' O ' ' HB ' ' A' ' 26' ' ' THR . 0.2 OUTLIER -114.72 125.72 54.05 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 118.826 -0.607 . . . . 0.0 110.607 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.55 ' H ' ' HA ' ' A' ' 29' ' ' GLN . 88.3 m 101.38 146.71 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 O-C-N 124.615 1.197 . . . . 0.0 110.778 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.556 ' HG2' ' HB3' ' B' ' 456' ' ' ASN . 24.2 ttt 79.43 -29.46 0.14 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.375 1.07 . . . . 0.0 110.452 -173.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HB3' ' HZ1' ' B' ' 453' ' ' LYS . 8.4 tp10 -142.09 -26.17 0.65 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 173.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.55 ' HA ' ' H ' ' A' ' 26' ' ' THR . 0.5 OUTLIER 59.92 88.01 0.08 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.001 -1.0 . . . . 0.0 112.493 176.257 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.614 ' HG3' HH22 ' A' ' 63' ' ' ARG . 23.7 ttmm -124.3 95.76 4.66 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.48 174.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.465 ' HG1' ' H ' ' A' ' 32' ' ' VAL . 26.9 p -66.97 -56.2 11.2 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.057 -173.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.465 ' H ' ' HG1' ' A' ' 31' ' ' THR . 8.4 p -90.42 140.33 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.889 0.375 . . . . 0.0 110.741 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.417 ' HB ' ' HD2' ' A' ' 34' ' ' PRO . 1.0 OUTLIER -70.35 162.63 68.76 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.128 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.417 ' HD2' ' HB ' ' A' ' 33' ' ' ILE . 78.2 Cg_exo -51.38 136.43 47.52 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.909 2.406 . . . . 0.0 112.629 178.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.86 -43.99 98.46 Favored Glycine 0 C--N 1.334 0.417 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.847 -178.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 70.7 mtm -109.88 150.22 41.06 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.503 0.192 . . . . 0.0 110.714 178.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -58.72 156.62 31.56 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 123.039 2.493 . . . . 0.0 112.644 178.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.494 ' HB ' HG22 ' B' ' 460' ' ' VAL . 43.3 p -99.59 -22.14 15.58 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.143 -176.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 28.4 m -59.22 129.69 21.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.799 -176.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.89 ' HB ' ' HD3' ' B' ' 462' ' ' LYS . 62.6 mt -115.44 125.85 28.38 Favored Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.827 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.681 ' HG2' HD21 ' A' ' 44' ' ' LEU . 25.5 Cg_endo -61.19 158.74 33.52 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.696 2.93 . . . . 0.0 113.922 -175.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 1.6 Cg_endo -81.42 108.89 2.01 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 123.436 2.758 . . . . 0.0 112.849 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 136.25 28.76 0.36 Allowed Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.396 178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.681 HD21 ' HG2' ' A' ' 41' ' ' PRO . 4.0 mm? -110.22 171.24 7.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.998 0.428 . . . . 0.0 111.168 -175.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.578 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 1.5 p -99.38 149.15 23.46 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.334 174.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.41 ' HD3' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -58.64 -31.32 68.02 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.329 -178.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.578 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.33 -45.18 61.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.16 -33.1 72.88 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.761 -177.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.739 ' HG2' HG21 ' A' ' 40' ' ' ILE . 51.1 mt-10 -61.24 -44.75 96.75 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.225 178.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.456 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.89 -43.39 98.93 Favored 'General case' 0 C--O 1.185 -2.316 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.248 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.456 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.26 -41.09 83.5 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 123.789 0.681 . . . . 0.0 111.626 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.79 -46.8 80.57 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.024 175.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.605 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 96.5 mt -64.49 -46.94 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.013 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 50' ' ' ARG . 34.9 m -68.04 -35.59 72.3 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.806 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.914 -177.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.12 -44.22 91.98 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.515 0.598 . . . . 0.0 110.349 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 1.7 pp -70.17 -28.55 65.42 Favored 'General case' 0 C--N 1.344 0.367 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.713 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.412 ' NE2' HD22 ' B' ' 382' ' ' ASN . 91.3 mt-30 -77.86 -34.68 51.64 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 120.873 0.368 . . . . 0.0 110.167 176.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.481 HD13 HD13 ' A' ' 113' ' ' ILE . 72.5 mt -62.9 -46.94 95.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.382 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.452 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.48 -41.28 84.84 Favored 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.703 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -68.31 -33.35 74.16 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.199 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.521 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.47 -44.98 77.28 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 173.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 m -65.63 -35.61 81.29 Favored 'General case' 0 N--CA 1.433 -1.305 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -178.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.614 HH22 ' HG3' ' A' ' 30' ' ' LYS . 39.1 ttp180 -55.82 -42.86 76.33 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 122.068 0.937 . . . . 0.0 108.495 176.158 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.521 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.71 -47.78 83.72 Favored 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.873 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.18 -28.86 63.49 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.856 177.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -67.97 -47.12 69.45 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.462 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.5 14.46 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -177.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.43 10.76 Favored Glycine 0 C--N 1.316 -0.57 0 C-N-CA 119.916 -1.135 . . . . 0.0 111.295 -177.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.34 88.85 6.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.258 0.552 . . . . 0.0 110.094 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 26.5 tp -130.16 -30.96 1.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.544 176.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 116.56 -133.1 10.51 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.792 -0.718 . . . . 0.0 113.054 177.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 5.9 tt -130.03 125.59 22.05 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.939 0.4 . . . . 0.0 111.364 -176.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.2 128.31 12.83 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.505 2.137 . . . . 0.0 111.826 175.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -62.8 -49.68 5.01 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.959 2.439 . . . . 0.0 112.748 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -133.41 134.92 24.41 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.271 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -72.0 132.89 20.54 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.835 2.356 . . . . 0.0 111.958 176.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.79 137.34 45.74 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.991 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.07 140.28 54.86 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.056 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 -86.11 153.14 22.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.576 -178.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.0 p -144.33 136.74 13.36 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 177.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -62.38 129.23 26.06 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.452 2.102 . . . . 0.0 112.212 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.8 m -139.77 104.9 6.89 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.256 -177.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -79.24 -179.56 5.53 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 123.335 2.69 . . . . 0.0 112.458 177.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.447 ' HG3' HD22 ' A' ' 88' ' ' ASN . 22.6 mm-40 -101.69 145.71 30.95 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 178.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 84' ' ' GLU . 32.0 Cg_exo -60.09 -39.2 71.82 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.998 2.465 . . . . 0.0 112.346 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 7.3 pt -109.86 166.41 5.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.917 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -92.15 101.17 13.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.108 175.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.447 HD22 ' HG3' ' A' ' 84' ' ' GLU . 8.4 p30 -105.08 143.55 33.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.716 -176.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 56.9 m -75.34 -24.45 57.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.809 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -82.91 161.97 21.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.973 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 126.75 59.81 0.14 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.755 178.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -102.81 -55.56 2.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.754 0.311 . . . . 0.0 110.583 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -98.6 84.74 3.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.161 0.505 . . . . 0.0 110.186 175.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.1 mt -91.37 131.02 37.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.272 -176.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -118.13 159.78 22.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.185 178.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.1 t -157.8 -50.11 0.07 Allowed 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.787 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.16 -52.52 16.21 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.247 -0.908 . . . . 0.0 109.692 -178.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.6 mp0 -53.3 -51.67 61.58 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.614 -1.63 . . . . 0.0 110.714 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -66.78 -38.56 86.8 Favored 'General case' 0 N--CA 1.427 -1.59 0 CA-C-N 113.42 -1.718 . . . . 0.0 110.681 -177.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.506 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.89 -44.57 94.16 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.267 0.355 . . . . 0.0 110.379 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.71 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 16.0 m -69.01 -50.01 52.67 Favored 'General case' 0 N--CA 1.428 -1.561 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.649 179.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.4 -41.36 93.75 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -175.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.01 -39.15 90.02 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 110.381 -0.229 . . . . 0.0 110.381 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.517 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.15 -40.17 88.96 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.71 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.93 -41.02 97.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.719 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.12 -34.39 78.28 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.707 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.31 74.2 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.517 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.51 -48.84 75.95 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 175.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.543 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.32 -45.44 94.43 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.404 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.21 -37.51 85.6 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 123.603 0.761 . . . . 0.0 110.991 -178.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.84 -43.73 86.06 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.2 mt -72.21 -38.61 68.97 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.753 177.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.543 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.39 -50.86 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 120.464 0.173 . . . . 0.0 110.544 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.3 m -60.63 -39.58 88.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.221 0.534 . . . . 0.0 110.548 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.593 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.55 61.04 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.981 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.11 84.48 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.3 t -65.49 -36.88 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.19 0.519 . . . . 0.0 109.642 176.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.61 -40.77 80.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.171 0.51 . . . . 0.0 110.26 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.2 mt -71.33 -40.69 70.58 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.069 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -133.53 111.14 12.57 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.323 -0.398 . . . . 0.0 109.992 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.69 -22.72 37.06 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.885 2.39 . . . . 0.0 112.57 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.24 0.04 55.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.35 0.595 . . . . 0.0 111.198 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.85 134.58 54.36 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.673 -178.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.36 109.18 62.91 Favored Pre-proline 0 CA--C 1.509 -0.615 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.308 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.29 157.97 59.52 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.247 1.965 . . . . 0.0 111.419 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.65 154.51 25.28 Favored 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 123.673 2.915 . . . . 0.0 111.737 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.31 69.38 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -173.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -85.45 34.11 0.57 Allowed 'General case' 0 CA--C 1.532 0.288 0 O-C-N 123.603 0.564 . . . . 0.0 111.224 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -93.34 129.2 39.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.52 177.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -114.01 128.26 25.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.493 177.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -66.75 160.21 47.61 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.917 2.411 . . . . 0.0 112.293 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.96 -0.82 9.58 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.76 2.306 . . . . 0.0 113.267 178.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -88.11 139.79 30.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.881 0.372 . . . . 0.0 111.205 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 11.1 t -89.43 158.21 17.83 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.089 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 20.2 ttm180 -98.77 139.94 33.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.967 -178.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 16.4 m -98.86 -175.94 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.23 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 53.0 t -123.85 -62.68 1.28 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.458 -178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -70.65 130.17 41.09 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.156 -177.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 20.1 tptm 59.96 89.35 0.07 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.728 0.643 . . . . 0.0 111.462 -178.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 5.9 m -76.46 137.87 21.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.194 179.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 51.9 ttm -93.6 147.52 22.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.757 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 36.0 mt -67.37 117.14 43.95 Favored Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.785 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -69.8 148.77 65.53 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.987 2.458 . . . . 0.0 112.557 -177.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -91.24 102.02 14.73 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.561 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 20.5 t70 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.18 -0.914 . . . . 0.0 111.01 -179.437 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -113.36 117.81 44.7 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.631 0.253 . . . . 0.0 111.105 -178.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.26 157.81 33.43 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.83 2.354 . . . . 0.0 111.756 174.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 375' ' ' THR . . . . . 0.44 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -119.67 -71.33 0.74 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.124 177.903 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 376' ' ' GLU . . . . . 0.479 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.88 -45.96 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 377' ' ' VAL . . . . . 0.436 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.66 150.98 7.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.431 -179.411 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 378' ' ' LEU . . . . . 0.551 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.72 152.54 20.78 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.182 -179.026 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 379' ' ' CYS . . . . . 0.572 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.52 142.6 46.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.623 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . 0.427 HD12 HG11 ' B' ' 434' ' ' VAL . 5.3 mt -132.74 101.27 5.21 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.0 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 381' ' ' MET . . . . . 0.753 ' HE3' ' HG2' ' B' ' 431' ' ' LYS . 43.3 ttm -118.02 165.58 13.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.784 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 382' ' ' ASN . . . . . 0.412 HD22 ' NE2' ' A' ' 57' ' ' GLN . 13.4 t30 59.07 51.22 7.3 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 123.635 0.584 . . . . 0.0 111.273 -178.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 383' ' ' MET . . . . . 0.679 ' HB3' HG13 ' B' ' 459' ' ' VAL . 3.0 ptm -164.89 14.4 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.233 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 384' ' ' VAL . . . . . 0.478 HG13 HD11 ' B' ' 398' ' ' ILE . 0.5 OUTLIER -152.3 125.09 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 0.0 111.42 179.865 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . . . . . . . . . 20.2 mt -110.66 151.81 43.05 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.389 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -63.26 -23.49 72.39 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.293 1.995 . . . . 0.0 112.293 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.78 -5.5 53.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.552 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -110.15 -36.69 5.77 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.9 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 389' ' ' LEU . . . . . 0.46 HD12 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.99 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.997 0.427 . . . . 0.0 110.616 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 390' ' ' LEU . . . . . 0.521 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.52 -15.81 5.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.652 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -98.31 148.83 23.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.565 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -73.63 -30.16 62.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.201 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.42 -47.59 26.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.001 0.429 . . . . 0.0 110.765 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.56 -44.33 91.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.748 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.27 -59.43 4.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.245 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.06 -27.31 61.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.185 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -40.99 67.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.405 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 398' ' ' ILE . . . . . 0.478 HD11 HG13 ' B' ' 384' ' ' VAL . 65.1 mt -74.88 -53.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.505 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 399' ' ' VAL . . . . . 0.581 HG23 HD12 ' B' ' 417' ' ' ILE . 59.6 t -53.31 -46.98 57.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.775 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.94 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.756 0.312 . . . . 0.0 111.548 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.65 -57.25 11.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.288 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.04 -32.9 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.391 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 403' ' ' ARG . . . . . 0.438 ' HA ' HD12 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.21 -57.31 4.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.824 0.345 . . . . 0.0 111.214 -179.989 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.95 -33.64 64.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.122 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 405' ' ' GLU . . . . . 0.517 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.53 -47.05 43.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.919 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.87 -23.97 67.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.148 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.07 30.41 1.09 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.981 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.15 -17.11 12.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 409' ' ' TYR . . . . . 0.534 ' HH ' HD21 ' B' ' 449' ' ' LEU . 1.8 m-85 -106.7 -15.48 14.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.535 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.37 4.12 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.627 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 411' ' ' LEU . . . . . 0.428 ' HB3' HG21 ' B' ' 437' ' ' THR . 1.6 mm? -114.26 132.51 56.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.612 0.244 . . . . 0.0 111.083 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.51 115.47 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.101 0.477 . . . . 0.0 110.532 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . 0.595 ' HG3' HG23 ' B' ' 437' ' ' THR . 10.8 mttt -56.6 -61.93 2.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.239 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.9 p -153.05 -169.38 3.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.171 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 415' ' ' ILE . . . . . 0.591 HG22 HG12 ' B' ' 434' ' ' VAL . 48.5 mt -145.12 128.96 12.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.848 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 416' ' ' GLU . . . . . 0.411 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.91 108.77 18.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.68 179.792 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 417' ' ' ILE . . . . . 0.599 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.7 mt -128.51 108.63 19.09 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.663 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 418' ' ' PRO . . . . . 0.646 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.61 147.7 9.2 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.587 2.191 . . . . 0.0 112.919 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 419' ' ' ARG . . . . . 0.521 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.92 74.67 21.85 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.13 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -47.08 117.11 2.02 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.752 2.302 . . . . 0.0 112.407 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 421' ' ' VAL . . . . . 0.52 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.6 t -74.43 97.84 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.942 0.401 . . . . 0.0 111.2 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.51 21.85 9.01 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.49 0.662 . . . . 0.0 109.321 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 423' ' ' GLY . . . . . 0.569 ' HA2' HG22 ' B' ' 426' ' ' VAL . . . 102.28 29.26 6.09 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-N 114.755 -1.111 . . . . 0.0 111.346 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 424' ' ' VAL . . . . . 0.52 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.41 -37.6 31.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.84 35.86 4.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.817 0.342 . . . . 0.0 111.805 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 426' ' ' VAL . . . . . 0.645 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.37 -44.72 47.55 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.755 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 427' ' ' PRO . . . . . 0.645 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.24 77.11 0.33 Allowed 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.5 2.134 . . . . 0.0 111.053 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.31 -15.42 3.21 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.358 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.9 t -67.64 149.39 50.12 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.519 0.199 . . . . 0.0 110.766 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.51 -14.14 5.07 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.854 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 431' ' ' LYS . . . . . 0.753 ' HG2' ' HE3' ' B' ' 381' ' ' MET . 0.0 OUTLIER -125.45 126.07 44.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.774 0.321 . . . . 0.0 111.072 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 432' ' ' ILE . . . . . 0.646 HG22 ' HD2' ' B' ' 418' ' ' PRO . 7.9 pt -131.02 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.258 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 433' ' ' PHE . . . . . 0.572 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.38 2.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.032 0.444 . . . . 0.0 111.926 -178.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 434' ' ' VAL . . . . . 0.591 HG12 HG22 ' B' ' 415' ' ' ILE . 3.2 m -135.84 141.69 41.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.207 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 435' ' ' GLU . . . . . 0.48 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.38 108.63 17.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.833 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.82 168.41 12.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.239 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 437' ' ' THR . . . . . 0.595 HG23 ' HG3' ' B' ' 413' ' ' LYS . 27.1 p -94.93 -45.39 7.29 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.519 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.84 146.66 52.25 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.057 0.456 . . . . 0.0 111.216 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.26 -12.75 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.212 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.64 -54.86 25.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.156 0.503 . . . . 0.0 110.132 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -75.1 -29.44 60.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.859 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -31.72 72.3 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.22 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.64 -48.07 15.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.63 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.63 -12.04 59.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.762 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -56.03 3.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.914 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 446' ' ' MET . . . . . 0.551 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.6 OUTLIER -62.88 -28.07 69.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.464 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.67 -16.18 63.31 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.598 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.65 -8.59 22.51 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.408 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 449' ' ' LEU . . . . . 0.534 HD21 ' HH ' ' B' ' 409' ' ' TYR . 97.2 mt -95.73 -19.7 19.47 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.764 0.316 . . . . 0.0 110.915 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 4.4 t -76.78 129.32 36.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.131 0.491 . . . . 0.0 110.956 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 97.08 -10.22 65.69 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.994 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -76.09 -152.2 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 117.081 0.44 . . . . 0.0 110.492 178.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 453' ' ' LYS . . . . . 0.503 ' HZ1' ' HB3' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -160.84 117.06 2.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.859 0.361 . . . . 0.0 111.306 -179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.17 -36.38 75.2 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.537 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.28 -50.96 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.788 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 456' ' ' ASN . . . . . 0.556 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 6.4 p30 -157.17 24.94 0.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.704 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 457' ' ' ARG . . . . . 0.414 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.57 135.4 18.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.244 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 14.7 p -59.86 139.06 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.666 177.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 459' ' ' VAL . . . . . 0.679 HG13 ' HB3' ' B' ' 383' ' ' MET . 14.7 m -102.18 125.85 56.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.258 0.551 . . . . 0.0 111.843 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 460' ' ' VAL . . . . . 0.605 HG23 HG22 ' A' ' 53' ' ' ILE . 77.7 t -91.65 103.01 14.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.058 175.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 35.7 p -106.77 113.12 26.42 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.053 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 462' ' ' LYS . . . . . 0.89 ' HD3' ' HB ' ' A' ' 40' ' ' ILE . 5.5 pttm -121.28 -157.33 0.72 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.343 0.592 . . . . 0.0 111.727 -178.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 463' ' ' TYR . . . . . 0.49 ' H ' ' HB2' ' B' ' 462' ' ' LYS . 1.3 m-85 -114.88 146.97 40.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.581 -172.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 464' ' ' CYS . . . . . 0.436 ' O ' HG21 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.86 149.07 47.47 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.131 0.491 . . . . 0.0 111.284 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 465' ' ' ASP . . . . . 0.44 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.44 129.36 66.41 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.351 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 466' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.3 Cg_endo -54.05 -33.32 72.96 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.763 2.309 . . . . 0.0 112.12 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.94 -58.52 7.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.445 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.41 -33.82 68.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.282 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 469' ' ' TYR . . . . . 0.48 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -59.96 -51.28 70.35 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.177 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.31 -47.55 69.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.358 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 471' ' ' ARG . . . . . 0.461 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.15 49.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.383 -179.862 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.09 20.84 8.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.917 0.389 . . . . 0.0 110.247 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 473' ' ' ASP . . . . . 0.461 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.78 -20.67 23.63 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.94 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.29 29.17 6.22 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.294 -178.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 59.0 m95 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.16 -0.924 . . . . 0.0 111.446 -179.214 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.0 mtp . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.766 0.317 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.55 124.07 31.7 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.092 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.9 t -123.38 139.31 54.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.053 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 141.02 -90.66 0.18 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.573 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -117.85 170.12 9.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.699 0.285 . . . . 0.0 111.015 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.448 ' HB3' ' H ' ' A' ' 7' ' ' ALA . 21.7 t-20 -100.28 -89.87 0.33 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.814 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.448 ' H ' ' HB3' ' A' ' 6' ' ' ASN . . . -156.7 51.47 0.5 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.051 0.453 . . . . 0.0 110.679 179.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.472 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.1 t -83.89 134.66 43.73 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.474 -179.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 17.1 Cg_exo -68.13 139.35 46.23 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.936 2.424 . . . . 0.0 112.218 176.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.5 161.63 21.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.094 0.474 . . . . 0.0 111.315 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -117.89 110.94 18.36 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.879 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.456 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 15.0 m-85 -81.88 131.98 55.57 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.469 176.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 39.1 Cg_exo -56.54 115.53 2.54 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.287 2.658 . . . . 0.0 112.354 -173.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.01 -166.75 1.32 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.85 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.38 51.93 12.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.41 -36.23 3.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.974 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.84 2.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.92 -54.2 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.783 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.83 111.22 13.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.03 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.57 24.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.739 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.55 12.79 19.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.995 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.508 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.7 m95 -142.05 53.05 1.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.994 0.426 . . . . 0.0 110.83 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.2 -156.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.885 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.458 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.35 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.883 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.83 124.67 52.34 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-O 118.93 -0.557 . . . . 0.0 110.57 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.547 HG22 ' H ' ' A' ' 27' ' ' MET . 0.2 OUTLIER -143.6 -176.27 4.89 Favored 'General case' 0 C--N 1.328 -0.364 0 O-C-N 123.872 0.732 . . . . 0.0 110.041 172.802 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.547 ' H ' HG22 ' A' ' 26' ' ' THR . 4.6 mpp? -110.28 -38.41 5.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.775 0.321 . . . . 0.0 110.742 177.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -108.9 -22.33 12.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.709 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.519 ' HB2' HG23 ' A' ' 26' ' ' THR . 11.8 mm100 -114.58 41.48 2.33 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.319 -178.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.449 ' HB2' ' H ' ' A' ' 26' ' ' THR . 81.0 tttt -129.76 138.07 50.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.819 0.343 . . . . 0.0 111.022 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.484 ' HG1' ' HZ1' ' B' ' 453' ' ' LYS . 29.4 p -126.02 -58.56 1.37 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.882 176.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.526 ' HA ' HH22 ' A' ' 63' ' ' ARG . 13.9 m -112.49 144.35 20.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.087 0.47 . . . . 0.0 111.87 -177.128 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.449 ' H ' HH22 ' A' ' 63' ' ' ARG . 1.0 OUTLIER -79.94 154.34 75.31 Favored Pre-proline 0 CA--C 1.53 0.176 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.861 177.325 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.11 155.77 60.77 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.732 2.288 . . . . 0.0 113.126 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.74 16.9 2.39 Favored Glycine 0 N--CA 1.452 -0.293 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.627 178.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -128.11 121.82 21.88 Favored Pre-proline 0 C--O 1.233 0.211 0 CA-C-O 120.658 0.266 . . . . 0.0 111.281 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -73.65 147.25 39.98 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.864 2.376 . . . . 0.0 111.978 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.653 ' HB ' HG12 ' B' ' 460' ' ' VAL . 55.4 p -138.14 90.84 2.51 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-O 121.138 0.494 . . . . 0.0 111.32 -175.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.1 m -142.71 133.23 23.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.714 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.809 ' H ' ' HB3' ' B' ' 462' ' ' LYS . 0.4 OUTLIER -93.98 135.56 24.61 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.533 179.164 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 40' ' ' ILE . 13.6 Cg_exo -70.62 169.11 20.78 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 123.539 2.826 . . . . 0.0 113.117 -177.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -78.27 121.12 5.14 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.649 2.233 . . . . 0.0 113.222 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 109.36 38.95 1.71 Allowed Glycine 0 C--N 1.33 0.218 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.74 176.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.459 ' HB3' ' HG3' ' A' ' 49' ' ' GLU . 3.8 mm? -113.58 129.54 56.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.769 0.318 . . . . 0.0 111.077 -173.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.438 ' HG1' ' H ' ' A' ' 48' ' ' GLN . 54.7 p -79.19 159.07 27.53 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -31.32 71.01 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 120.878 0.37 . . . . 0.0 111.305 -175.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -72.27 -45.12 61.48 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.438 ' H ' ' HG1' ' A' ' 45' ' ' THR . 5.2 tp-100 -69.3 -33.28 72.93 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.695 -177.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.555 ' HG2' HG12 ' A' ' 40' ' ' ILE . 35.6 mt-10 -60.56 -45.21 94.75 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.145 177.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.446 ' O ' HG22 ' A' ' 54' ' ' VAL . 16.0 mmt180 -62.81 -43.32 99.11 Favored 'General case' 0 C--O 1.185 -2.327 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.211 177.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.453 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.42 -41.44 85.03 Favored 'General case' 0 C--N 1.32 -0.699 0 O-C-N 123.78 0.675 . . . . 0.0 111.632 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -65.3 -44.76 86.88 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.842 177.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.686 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 92.2 mt -69.18 -44.83 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.309 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.453 HG22 ' HA ' ' A' ' 51' ' ' ALA . 35.1 m -67.05 -35.49 74.66 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.71 0 CA-C-O 118.656 -0.688 . . . . 0.0 111.873 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.18 -44.77 92.17 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.595 0.634 . . . . 0.0 110.335 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.686 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 3.3 pp -72.12 -23.17 61.28 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.125 -178.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -85.86 -30.67 22.73 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.199 175.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 54' ' ' VAL . 73.2 mt -62.59 -47.01 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.07 0.548 . . . . 0.0 110.411 172.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.471 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.34 -41.72 84.75 Favored 'General case' 0 CA--C 1.512 -0.482 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.667 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -68.53 -32.82 73.04 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.37 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.528 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.37 -45.1 77.27 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 173.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 m -65.47 -35.76 81.87 Favored 'General case' 0 N--CA 1.433 -1.288 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.526 HH22 ' HA ' ' A' ' 32' ' ' VAL . 39.2 ttp180 -55.73 -42.82 75.92 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.528 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.0 ttmt -61.83 -47.68 84.01 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.798 -1.546 . . . . 0.0 111.913 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.21 -28.86 63.45 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 119.758 -0.777 . . . . 0.0 111.888 176.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.92 -47.25 69.27 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.42 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.11 -17.51 14.46 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.926 -0.709 . . . . 0.0 112.904 -177.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.75 29.49 10.67 Favored Glycine 0 C--N 1.316 -0.528 0 C-N-CA 119.887 -1.149 . . . . 0.0 111.307 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.42 93.16 7.16 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.244 0.545 . . . . 0.0 110.261 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 23.3 tp -112.82 -39.42 4.28 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.68 178.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -151.19 -113.42 0.59 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.59 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 29.2 pt -85.74 153.95 58.35 Favored Pre-proline 0 CA--C 1.53 0.192 0 CA-C-O 120.796 0.331 . . . . 0.0 111.538 -178.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.77 156.02 61.5 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.864 2.376 . . . . 0.0 112.368 177.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.13 133.06 47.7 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.935 2.423 . . . . 0.0 112.837 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.46 ' HA ' ' HD3' ' A' ' 76' ' ' PRO . 16.0 m120 -91.33 141.39 26.08 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.987 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 75' ' ' ASN . 6.0 Cg_exo -80.42 76.59 4.45 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.3 2.667 . . . . 0.0 112.46 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -160.53 -60.12 0.06 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.567 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -121.15 121.38 37.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.699 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -106.03 -63.23 1.28 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.424 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.453 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 67.1 m -128.5 109.87 19.19 Favored Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.82 179.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 80' ' ' SER . 2.7 Cg_exo -76.6 149.62 30.6 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.334 2.689 . . . . 0.0 112.645 -178.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 45.7 t -136.5 120.33 12.4 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.797 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -68.94 163.79 36.17 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.98 2.454 . . . . 0.0 112.684 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.756 ' HB3' ' HD3' ' A' ' 85' ' ' PRO . 38.9 tt0 -69.03 -54.34 12.32 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.549 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.756 ' HD3' ' HB3' ' A' ' 84' ' ' GLU . 9.8 Cg_exo -72.6 173.81 12.7 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 122.369 2.046 . . . . 0.0 112.256 177.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 17.8 tt -78.44 137.05 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.091 0.472 . . . . 0.0 110.966 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -75.64 133.84 40.76 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.724 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -80.22 133.82 36.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.015 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 35.0 t -74.55 -45.76 43.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.781 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 63.72 -91.27 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.97 0.794 . . . . 0.0 111.505 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -172.57 38.25 0.15 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.434 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -86.34 -59.65 2.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.335 0.112 . . . . 0.0 110.862 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 33.1 ttm180 71.91 -76.36 0.07 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 124.152 0.907 . . . . 0.0 112.351 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 88.3 mt -91.92 -162.86 0.97 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.888 0.375 . . . . 0.0 111.758 -176.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -74.88 147.53 40.97 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.349 0.595 . . . . 0.0 112.191 -176.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -140.22 -50.02 0.47 Allowed 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.737 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.19 -52.56 15.98 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.273 -0.892 . . . . 0.0 109.598 -178.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.6 mp0 -53.27 -51.75 61.27 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-N 113.616 -1.629 . . . . 0.0 110.614 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.77 -38.61 86.92 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.482 -1.69 . . . . 0.0 110.626 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.509 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.92 -44.6 94.21 Favored 'General case' 0 CA--C 1.51 -0.563 0 O-C-N 123.182 0.302 . . . . 0.0 110.38 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.704 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.6 m -68.95 -50.03 52.8 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.679 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.37 -41.32 93.91 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 -175.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.97 -39.24 90.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.595 0.236 . . . . 0.0 110.373 178.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.17 -40.19 89.07 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.89 -41.08 97.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.7 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.06 -34.32 78.13 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.734 178.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.39 74.31 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 177.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.46 -48.8 76.21 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 175.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.54 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.23 -45.59 93.92 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.405 179.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.26 -37.41 85.35 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 123.579 0.751 . . . . 0.0 111.019 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.79 -43.81 85.85 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 177.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.5 mt -72.17 -38.67 69.07 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.157 -0.928 . . . . 0.0 110.75 177.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.54 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.35 -50.88 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 N-CA-C 110.488 -0.19 . . . . 0.0 110.488 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 96.0 m -60.79 -39.44 88.9 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.272 0.558 . . . . 0.0 110.589 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.601 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.88 -49.55 61.39 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.063 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.4 -37.11 84.51 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -177.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.1 t -65.57 -36.81 78.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.63 -40.78 80.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.206 0.527 . . . . 0.0 110.231 177.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.2 mt -71.4 -40.65 70.39 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.019 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.57 111.22 12.54 Favored Pre-proline 0 C--N 1.317 -0.834 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.79 -22.66 36.55 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.765 2.31 . . . . 0.0 112.531 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.24 0.06 55.95 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.353 0.596 . . . . 0.0 111.175 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.91 134.64 54.42 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.61 -178.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.43 109.21 62.95 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.251 177.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.26 157.89 59.86 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.305 2.004 . . . . 0.0 111.516 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.57 154.5 24.88 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 123.603 2.869 . . . . 0.0 111.809 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.16 -28.59 67.42 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -173.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -71.61 -12.36 61.31 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -164.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -138.42 115.31 10.79 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.187 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -94.5 129.11 37.65 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.254 178.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -59.57 139.05 87.25 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.897 2.398 . . . . 0.0 112.583 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -68.73 -10.63 29.65 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.271 2.647 . . . . 0.0 112.793 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -79.65 -15.3 57.84 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.987 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 15.5 m -84.8 105.06 15.3 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -95.51 110.33 22.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.164 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 2.9 m -104.01 117.54 49.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.07 178.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 42.9 t -114.85 145.91 41.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.833 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -131.82 150.22 52.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.035 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -106.43 85.33 2.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.324 177.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 12.0 p -89.97 138.29 19.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.212 -177.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 47.2 ttm -97.12 133.86 41.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.5 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.501 HG13 ' HD2' ' A' ' 143' ' ' PRO . 8.8 tt -79.6 130.42 67.98 Favored Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.821 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.501 ' HD2' HG13 ' A' ' 142' ' ' ILE . 18.9 Cg_endo -60.67 143.58 99.43 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.93 2.42 . . . . 0.0 112.871 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -84.78 156.13 21.52 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.035 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 . . . . . 0 C--O 1.251 1.147 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.503 -179.853 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.156 0 N-CA-C 112.417 -0.273 . . . . 0.0 112.417 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 65.42 103.69 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.497 0 C-N-CA 123.15 0.58 . . . . 0.0 111.73 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -83.8 155.22 13.49 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.911 2.407 . . . . 0.0 112.363 176.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 375' ' ' THR . . . . . 0.443 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -127.5 -71.23 0.67 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.123 175.253 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 376' ' ' GLU . . . . . 0.474 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.85 -45.98 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 377' ' ' VAL . . . . . 0.441 HG23 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.99 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.465 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 378' ' ' LEU . . . . . 0.511 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.61 152.51 20.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.233 -179.057 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 379' ' ' CYS . . . . . 0.578 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.55 142.59 46.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.629 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . 0.437 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.76 101.72 5.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.91 0.385 . . . . 0.0 110.958 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 381' ' ' MET . . . . . 0.535 ' HE3' ' HG2' ' B' ' 431' ' ' LYS . 85.3 mtp -119.12 166.43 12.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.97 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.7 51.26 7.88 Favored 'General case' 0 C--O 1.232 0.133 0 O-C-N 123.821 0.7 . . . . 0.0 111.345 -178.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 383' ' ' MET . . . . . 0.463 ' HE3' HD13 ' B' ' 432' ' ' ILE . 3.0 ptm -164.88 14.41 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.237 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 384' ' ' VAL . . . . . 0.502 HG23 HG22 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.3 125.01 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.382 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . . . . . . . . . 20.1 mt -110.61 151.78 43.01 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.468 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.2 -23.4 72.77 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.323 2.015 . . . . 0.0 112.279 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.9 -5.53 53.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.526 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.13 -36.71 5.77 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.848 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 389' ' ' LEU . . . . . 0.443 HD13 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.99 34.95 0.46 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.008 0.432 . . . . 0.0 110.669 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 390' ' ' LEU . . . . . 0.52 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.53 -15.72 5.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.693 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -98.34 148.77 23.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.553 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -73.55 -30.29 62.97 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.203 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -75.38 -47.58 26.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.768 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.63 -44.21 91.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.802 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.37 -59.47 4.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.193 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -27.32 61.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.234 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.17 -40.99 67.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.471 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 398' ' ' ILE . . . . . 0.474 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.91 -53.61 16.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.539 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 399' ' ' VAL . . . . . 0.559 HG23 HD13 ' B' ' 417' ' ' ILE . 59.3 t -53.4 -46.84 58.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.801 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.51 -59.94 3.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.52 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.68 -57.08 12.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.441 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.14 -32.86 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.346 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 403' ' ' ARG . . . . . 0.44 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.22 -57.42 4.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.766 0.317 . . . . 0.0 111.113 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.96 -33.68 64.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.127 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 405' ' ' GLU . . . . . 0.508 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 22.0 mm-40 -73.39 -47.02 45.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.981 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.85 -23.98 67.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.187 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.14 30.37 1.11 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.932 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.09 -17.12 12.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 409' ' ' TYR . . . . . 0.575 ' HH ' HD21 ' B' ' 449' ' ' LEU . 1.9 m-85 -106.69 -15.45 14.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.493 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.17 -139.4 4.14 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.61 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 411' ' ' LEU . . . . . 0.424 ' HB3' HG21 ' B' ' 437' ' ' THR . 1.6 mm? -114.25 132.47 56.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.677 0.275 . . . . 0.0 111.07 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.4 p -117.43 115.45 48.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.02 0.438 . . . . 0.0 110.653 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . 0.602 ' HG3' HG23 ' B' ' 437' ' ' THR . 10.9 mttt -56.62 -61.97 2.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.177 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.7 p -153.07 -169.44 3.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.049 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 415' ' ' ILE . . . . . 0.593 HG22 HG11 ' B' ' 434' ' ' VAL . 48.4 mt -145.0 128.89 12.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.945 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 416' ' ' GLU . . . . . 0.403 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.84 108.79 18.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.889 0.376 . . . . 0.0 110.702 179.811 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 417' ' ' ILE . . . . . 0.587 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.4 mt -128.49 108.59 19.11 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.675 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 418' ' ' PRO . . . . . 0.645 ' HD2' HG23 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.54 147.62 9.1 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 122.669 2.246 . . . . 0.0 112.855 -179.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 419' ' ' ARG . . . . . 0.52 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.87 74.64 22.05 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.107 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.16 117.07 2.02 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.732 2.288 . . . . 0.0 112.477 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 421' ' ' VAL . . . . . 0.522 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.6 t -74.39 97.82 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.178 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.62 21.77 9.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.535 0.684 . . . . 0.0 109.298 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 423' ' ' GLY . . . . . 0.563 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.23 29.25 6.11 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.377 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 424' ' ' VAL . . . . . 0.522 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.45 -37.47 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.9 35.81 4.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.745 0.307 . . . . 0.0 111.745 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 426' ' ' VAL . . . . . 0.641 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.31 -44.69 48.1 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.792 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 427' ' ' PRO . . . . . 0.641 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.9 Cg_endo -66.25 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.491 2.128 . . . . 0.0 111.088 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.26 -15.44 3.22 Favored Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.344 -178.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.58 149.38 50.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.68 0.276 . . . . 0.0 110.771 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.13 5.06 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.845 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 431' ' ' LYS . . . . . 0.535 ' HG2' ' HE3' ' B' ' 381' ' ' MET . 0.0 OUTLIER -125.42 126.11 44.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.836 0.351 . . . . 0.0 111.108 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 432' ' ' ILE . . . . . 0.645 HG23 ' HD2' ' B' ' 418' ' ' PRO . 7.8 pt -131.06 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.231 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 433' ' ' PHE . . . . . 0.578 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.47 -176.36 2.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.982 0.42 . . . . 0.0 111.939 -178.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 434' ' ' VAL . . . . . 0.593 HG11 HG22 ' B' ' 415' ' ' ILE . 3.3 m -135.87 141.75 41.02 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.145 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 435' ' ' GLU . . . . . 0.473 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.36 108.5 17.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.845 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.76 168.29 12.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.251 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 437' ' ' THR . . . . . 0.602 HG23 ' HG3' ' B' ' 413' ' ' LYS . 27.0 p -94.86 -45.42 7.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.517 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.89 146.57 52.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.99 0.424 . . . . 0.0 111.25 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.19 -12.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.236 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -54.86 25.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.149 0.5 . . . . 0.0 110.043 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.13 -29.5 60.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.829 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.12 -31.86 72.37 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.19 179.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.61 -48.01 15.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.641 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.63 -12.02 59.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.738 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -55.73 3.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.902 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 446' ' ' MET . . . . . 0.542 ' HE1' ' HA ' ' B' ' 462' ' ' LYS . 0.3 OUTLIER -63.69 -27.46 69.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.25 -179.678 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.87 -16.33 63.23 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.574 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.64 22.53 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.425 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 449' ' ' LEU . . . . . 0.575 HD21 ' HH ' ' B' ' 409' ' ' TYR . 97.2 mt -95.61 -19.52 19.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.784 0.326 . . . . 0.0 111.004 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 1.7 t -72.37 132.28 43.74 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.894 176.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 92.45 -9.55 75.78 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.299 178.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -77.07 -152.25 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 117.313 0.556 . . . . 0.0 110.525 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 453' ' ' LYS . . . . . 0.484 ' HZ1' ' HG1' ' A' ' 31' ' ' THR . 0.0 OUTLIER -160.8 117.1 2.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.884 0.373 . . . . 0.0 111.331 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.27 -36.32 75.33 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.549 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.833 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 456' ' ' ASN . . . . . 0.439 ' HB3' ' NE2' ' A' ' 29' ' ' GLN . 6.4 p30 -157.19 24.91 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.731 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 457' ' ' ARG . . . . . 0.411 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.48 135.73 19.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.301 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 14.8 p -60.83 137.28 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.968 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 45.0 t -99.77 115.36 40.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.414 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 460' ' ' VAL . . . . . 0.653 HG12 ' HB ' ' A' ' 38' ' ' THR . 39.7 t -84.88 102.76 11.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.959 176.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 21.4 p -102.68 123.13 45.8 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.377 -177.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 462' ' ' LYS . . . . . 0.809 ' HB3' ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -130.56 -159.38 0.96 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.279 0.562 . . . . 0.0 111.758 -179.485 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 463' ' ' TYR . . . . . 0.467 ' CD2' ' HE2' ' B' ' 446' ' ' MET . 1.3 m-85 -114.7 147.0 40.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.667 -171.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 464' ' ' CYS . . . . . 0.441 ' O ' HG23 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.9 148.98 47.36 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.068 0.461 . . . . 0.0 111.382 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 465' ' ' ASP . . . . . 0.443 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.36 129.37 66.64 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.378 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 466' ' ' PRO . . . . . 0.474 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.1 -33.24 73.14 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.677 2.251 . . . . 0.0 112.07 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.46 7.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.43 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.82 68.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.281 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 469' ' ' TYR . . . . . 0.473 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.03 -51.25 70.45 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.156 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -53.32 -47.52 69.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.4 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 471' ' ' ARG . . . . . 0.461 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.75 -2.06 49.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.415 -179.895 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.1 20.8 8.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.876 0.37 . . . . 0.0 110.236 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 473' ' ' ASP . . . . . 0.461 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.83 -19.85 19.58 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.927 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 66.55 24.05 10.3 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.014 0.526 . . . . 0.0 112.043 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.469 -0.776 . . . . 0.0 110.814 -179.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.1 mtt . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 120.992 0.425 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.95 -22.84 17.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.807 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.0 m -113.39 99.71 7.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.828 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -145.21 -72.74 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.979 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 63.24 -91.62 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 176.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -74.26 -72.26 0.29 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.722 0.296 . . . . 0.0 111.52 -176.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.72 166.35 10.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.012 0.434 . . . . 0.0 111.578 -177.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.429 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.6 t -85.38 137.99 36.51 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.149 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 32.8 Cg_exo -59.12 137.11 77.34 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.967 2.445 . . . . 0.0 112.226 178.566 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.453 HD21 ' HA ' ' A' ' 10' ' ' LEU . 12.1 mt -72.96 103.41 3.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.237 0.542 . . . . 0.0 111.588 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -147.19 0.44 0.71 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.652 176.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -99.35 139.55 21.01 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.807 -178.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -56.65 115.65 2.63 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 123.04 2.493 . . . . 0.0 112.205 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.0 -166.77 1.33 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.903 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.39 51.91 12.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.908 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.36 -36.18 3.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.05 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.84 91.91 2.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.87 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.89 -54.27 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.796 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.82 111.19 13.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.941 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.61 24.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.726 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.67 12.83 19.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.94 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.526 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.7 m95 -142.02 53.07 1.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.773 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.25 -156.56 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.459 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.31 -37.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.857 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.431 ' OD1' ' NZ ' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -114.64 119.65 37.48 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.518 179.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.644 HG23 ' H ' ' A' ' 27' ' ' MET . 0.2 OUTLIER 65.2 -166.6 0.22 Allowed 'General case' 0 CA--C 1.538 0.51 0 O-C-N 123.982 0.802 . . . . 0.0 109.854 -171.353 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.644 ' H ' HG23 ' A' ' 26' ' ' THR . 3.1 tpt -86.55 -24.29 25.52 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.673 0.273 . . . . 0.0 110.4 177.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -141.59 143.61 33.79 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.951 0.405 . . . . 0.0 111.147 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.428 ' HG3' ' H ' ' A' ' 31' ' ' THR . 5.8 tp-100 -157.88 153.79 26.88 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.378 -178.094 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -94.89 -27.72 15.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.197 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.428 ' H ' ' HG3' ' A' ' 29' ' ' GLN . 7.3 m -105.15 104.9 14.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.909 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.4 m -119.18 138.45 49.85 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-O 121.008 0.433 . . . . 0.0 111.657 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.54 126.5 8.11 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.083 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.95 131.61 13.38 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.606 2.204 . . . . 0.0 111.935 175.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -129.97 -94.13 0.7 Allowed Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.186 -1.006 . . . . 0.0 113.639 -175.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.459 ' HB2' HD11 ' A' ' 56' ' ' LEU . 21.7 mmt -71.81 138.79 82.75 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.878 0.371 . . . . 0.0 111.734 -174.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.484 ' HA ' ' HB ' ' B' ' 450' ' ' THR . 74.2 Cg_endo -79.17 155.34 25.64 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.991 2.461 . . . . 0.0 112.995 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.488 ' HB ' HD12 ' A' ' 53' ' ' ILE . 72.0 p -125.2 15.27 8.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.858 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.3 m -63.67 121.62 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.091 0.472 . . . . 0.0 111.472 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.818 ' H ' ' HG2' ' B' ' 462' ' ' LYS . 67.0 mt -111.92 121.37 39.8 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.245 -177.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -68.9 167.21 23.93 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 123.462 2.775 . . . . 0.0 113.23 -177.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.8 118.34 5.53 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.608 2.205 . . . . 0.0 113.156 178.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 124.63 41.74 0.37 Allowed Glycine 0 C--N 1.332 0.306 0 C-N-CA 121.072 -0.585 . . . . 0.0 112.342 175.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.412 HD11 ' HA ' ' A' ' 44' ' ' LEU . 3.2 mm? -124.65 145.1 49.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.015 0.436 . . . . 0.0 111.659 -175.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.496 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 16.1 p -89.75 158.0 17.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.163 174.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.412 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.78 -31.43 71.63 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 120.956 0.407 . . . . 0.0 111.317 -176.107 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.496 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.27 -45.22 61.05 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -69.14 -33.03 72.8 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.796 -177.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.541 ' HG2' HG23 ' A' ' 40' ' ' ILE . 39.9 mt-10 -62.2 -42.91 99.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.419 178.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.498 ' NH1' HD22 ' B' ' 382' ' ' ASN . 15.9 mmt180 -64.03 -43.36 95.8 Favored 'General case' 0 C--O 1.185 -2.302 0 CA-C-O 118.803 -0.618 . . . . 0.0 110.274 176.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.439 ' HA ' HG21 ' A' ' 54' ' ' VAL . . . -58.35 -41.87 85.66 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 123.792 0.683 . . . . 0.0 111.583 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -65.73 -43.19 89.79 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.744 0.307 . . . . 0.0 110.999 176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.781 ' HA ' HD23 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -73.22 -38.49 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.465 -178.708 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.439 HG21 ' HA ' ' A' ' 51' ' ' ALA . 35.1 m -70.34 -35.52 62.93 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.788 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.881 177.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.13 -43.89 92.02 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.591 0.632 . . . . 0.0 110.275 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.781 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.6 OUTLIER -65.24 -34.11 77.58 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.946 178.069 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -80.87 -29.23 35.77 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 54' ' ' VAL . 73.0 mt -65.08 -47.06 89.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.348 174.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.4 -41.93 84.11 Favored 'General case' 0 CA--C 1.513 -0.45 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.697 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -58.84 -43.78 90.79 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 124.887 1.367 . . . . 0.0 110.843 176.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.519 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -66.01 -44.94 83.31 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.401 178.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.468 ' HG1' ' HD3' ' A' ' 109' ' ' ARG . 24.0 m -65.56 -35.7 81.62 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -178.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.432 ' O ' HG22 ' A' ' 67' ' ' THR . 39.3 ttp180 -55.89 -42.68 76.34 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 122.069 0.937 . . . . 0.0 108.509 176.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.519 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.84 -47.78 83.53 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.836 -1.529 . . . . 0.0 111.883 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.16 -28.91 63.54 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 119.754 -0.778 . . . . 0.0 111.791 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -68.02 -47.1 69.38 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.11 -17.59 14.43 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 120.002 -0.679 . . . . 0.0 112.821 -177.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.8 29.44 10.66 Favored Glycine 0 C--N 1.315 -0.631 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.252 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.27 92.56 6.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.174 0.511 . . . . 0.0 110.268 -179.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.411 HD12 HD21 ' A' ' 105' ' ' LEU . 3.0 mm? -113.27 29.3 8.09 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.009 -1.45 . . . . 0.0 109.884 175.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 120.68 -61.29 0.52 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.877 178.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 13.0 pt -116.07 158.36 42.76 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 120.837 0.351 . . . . 0.0 111.742 -176.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -69.48 160.02 51.37 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 123.195 2.597 . . . . 0.0 112.196 176.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -64.48 131.61 30.45 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.944 2.429 . . . . 0.0 112.325 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -116.57 102.9 53.17 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.086 -179.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -83.73 -160.9 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.254 2.636 . . . . 0.0 112.375 177.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 63.12 92.07 0.07 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.565 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -118.12 142.47 47.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.038 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.415 ' O ' ' HD3' ' A' ' 81' ' ' PRO . 29.7 ttt180 -79.06 -65.9 0.94 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.534 -178.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.2 m -103.79 103.25 35.82 Favored Pre-proline 0 C--O 1.232 0.173 0 CA-C-O 120.747 0.308 . . . . 0.0 111.221 -176.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.415 ' HD3' ' O ' ' A' ' 79' ' ' ARG . 5.4 Cg_exo -79.89 139.31 13.72 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.096 2.531 . . . . 0.0 112.423 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 48.9 m -90.0 141.07 27.72 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.576 178.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.86 114.26 2.0 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.92 2.413 . . . . 0.0 112.474 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.86 160.73 35.67 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.878 -177.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.16 149.15 82.2 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.677 2.251 . . . . 0.0 112.294 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 19.8 pt -72.25 144.01 13.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.596 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -97.99 117.63 32.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.684 176.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -86.24 -174.48 5.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.575 -174.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 75.0 p -73.88 -11.99 60.53 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.642 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -70.96 -35.13 72.04 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.615 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 87.02 71.8 1.29 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.221 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 25.7 tttm -96.55 100.98 12.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.897 0.38 . . . . 0.0 111.11 -177.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -93.46 -14.64 26.47 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.632 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.2 mp -86.73 137.25 32.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.228 176.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -147.46 -83.08 0.12 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.381 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -158.32 -50.16 0.06 Allowed 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.15 -52.51 16.31 Favored 'General case' 0 C--N 1.306 -1.323 0 O-C-N 121.237 -0.914 . . . . 0.0 109.604 -178.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.4 mp0 -53.19 -51.77 61.03 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.704 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.68 -38.74 87.42 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 113.355 -1.748 . . . . 0.0 110.666 -177.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.93 -44.48 94.32 Favored 'General case' 0 CA--C 1.511 -0.537 0 O-C-N 123.17 0.294 . . . . 0.0 110.384 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.715 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.7 m -68.94 -50.13 51.96 Favored 'General case' 0 N--CA 1.429 -1.521 0 C-N-CA 120.104 -0.638 . . . . 0.0 110.644 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.41 -41.27 93.76 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -175.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.9 -39.27 90.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.588 0.232 . . . . 0.0 110.384 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.514 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.2 -40.13 88.99 Favored 'General case' 0 C--O 1.225 -0.235 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.8 mt -64.04 -40.98 97.51 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.673 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.04 -34.35 78.23 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.785 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.4 74.32 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 177.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.5 -48.82 76.04 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 175.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.537 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.21 -45.54 94.16 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.396 179.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.26 -37.4 85.33 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.016 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.82 -43.8 86.0 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 66.1 mt -72.19 -38.64 69.03 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.723 177.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.44 -50.77 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-O 120.474 0.178 . . . . 0.0 110.554 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.8 m -60.79 -39.49 89.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.301 0.572 . . . . 0.0 110.544 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.588 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.9 -49.63 60.88 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.015 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.35 -37.14 84.65 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -177.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.7 t -65.54 -36.83 78.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.61 -40.79 80.23 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.23 0.538 . . . . 0.0 110.213 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.5 mt -71.41 -40.69 70.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.006 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.57 111.24 12.54 Favored Pre-proline 0 C--N 1.315 -0.894 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.011 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.76 -22.7 36.69 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.836 2.357 . . . . 0.0 112.516 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.29 0.12 55.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.379 0.609 . . . . 0.0 111.203 -177.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.86 134.62 54.43 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.66 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.4 109.08 62.81 Favored Pre-proline 0 CA--C 1.509 -0.609 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.302 177.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -68.26 157.92 59.72 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.275 1.984 . . . . 0.0 111.503 178.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.58 154.5 24.89 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 123.615 2.877 . . . . 0.0 111.786 177.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.93 -30.17 69.41 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -173.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -75.96 -13.21 60.24 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 123.451 0.469 . . . . 0.0 111.748 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -61.3 134.0 56.48 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.0 0.429 . . . . 0.0 111.491 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 131' ' ' PRO . 91.0 mttt -106.39 123.13 39.81 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.883 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . 0.453 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 4.0 Cg_exo -77.53 136.0 15.19 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 123.117 2.544 . . . . 0.0 112.311 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 7.9 Cg_exo -73.58 137.73 25.66 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 123.048 2.498 . . . . 0.0 112.482 179.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -118.25 116.36 26.62 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.018 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 15.3 t -108.43 3.49 23.3 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.271 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -80.64 -75.24 0.28 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.224 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 2.4 m -122.38 167.61 15.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.172 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 80.5 m -100.86 -10.77 20.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.095 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -101.68 121.9 42.9 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.96 0.41 . . . . 0.0 111.238 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 96.5 mttt 62.5 -164.6 0.25 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.068 177.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 11.3 p -120.56 150.19 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.177 -177.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 15.4 tpt -92.35 121.09 33.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.572 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 49.7 mm -109.33 119.53 48.09 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.73 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -69.52 139.2 40.48 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.005 2.47 . . . . 0.0 112.485 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -92.35 121.87 34.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.074 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.414 -0.803 . . . . 0.0 110.808 179.176 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.304 0 N-CA-C 112.283 -0.327 . . . . 0.0 112.283 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 43.3 m80 -114.57 93.95 34.64 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 120.733 0.302 . . . . 0.0 110.288 177.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -75.44 136.33 19.39 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.284 2.656 . . . . 0.0 113.846 -174.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 375' ' ' THR . . . . . 0.449 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -115.63 -71.39 0.74 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.143 173.057 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 376' ' ' GLU . . . . . 0.473 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.92 0.01 OUTLIER 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 377' ' ' VAL . . . . . 0.442 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.64 151.0 7.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.432 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 378' ' ' LEU . . . . . 0.52 HD23 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.66 152.58 20.79 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.197 -179.055 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 379' ' ' CYS . . . . . 0.565 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.64 142.57 46.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.599 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . 0.523 HD21 HG22 ' B' ' 461' ' ' THR . 5.3 mt -132.76 101.18 5.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 381' ' ' MET . . . . . 0.435 ' HB3' ' HB ' ' B' ' 460' ' ' VAL . 18.3 ttp -116.65 165.92 12.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.596 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 382' ' ' ASN . . . . . 0.498 HD22 ' NH1' ' A' ' 50' ' ' ARG . 13.3 t30 58.31 51.13 8.69 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 123.536 0.523 . . . . 0.0 111.256 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 383' ' ' MET . . . . . 0.404 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.81 14.32 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.271 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 384' ' ' VAL . . . . . 0.483 HG11 HD11 ' B' ' 398' ' ' ILE . 0.4 OUTLIER -152.3 125.13 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.829 0.347 . . . . 0.0 111.326 179.878 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.67 151.74 43.01 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.406 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.1 -23.46 73.38 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.265 1.976 . . . . 0.0 112.352 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.86 -5.53 53.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.04 -36.69 5.79 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.909 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 389' ' ' LEU . . . . . 0.445 HD13 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -83.05 34.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.946 0.403 . . . . 0.0 110.603 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 390' ' ' LEU . . . . . 0.502 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.47 -15.73 5.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.726 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -98.28 148.74 23.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.582 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -73.56 -30.34 62.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.186 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.31 -47.68 26.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.729 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.48 -44.33 91.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.801 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -56.4 -59.4 5.02 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.211 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -27.35 61.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.23 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -40.99 67.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.42 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 398' ' ' ILE . . . . . 0.483 HD11 HG11 ' B' ' 384' ' ' VAL . 65.4 mt -74.9 -53.68 15.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.513 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 399' ' ' VAL . . . . . 0.582 HG22 HD12 ' B' ' 417' ' ' ILE . 59.5 t -53.34 -46.86 58.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.795 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.51 -59.92 3.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.516 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.68 -57.13 11.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.385 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.14 -32.83 15.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.375 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 403' ' ' ARG . . . . . 0.446 ' HA ' HD12 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.21 -57.43 4.5 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.746 0.307 . . . . 0.0 111.145 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.88 -33.64 64.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.177 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 405' ' ' GLU . . . . . 0.526 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.5 -47.02 44.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.978 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.83 -23.97 67.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.164 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 407' ' ' SER . . . . . 0.469 ' HG ' HG13 ' B' ' 412' ' ' VAL . 0.3 OUTLIER -90.04 30.27 1.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.972 -179.915 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.11 -17.07 12.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.89 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.67 -15.52 14.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.52 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.41 4.14 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.601 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 411' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.25 132.47 56.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.319 . . . . 0.0 111.086 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 412' ' ' VAL . . . . . 0.469 HG13 ' HG ' ' B' ' 407' ' ' SER . 7.5 p -117.39 115.49 48.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.061 0.457 . . . . 0.0 110.593 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . 0.608 ' HG3' HG23 ' B' ' 437' ' ' THR . 10.9 mttt -56.63 -61.98 2.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.184 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.9 p -152.96 -169.35 3.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.113 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 415' ' ' ILE . . . . . 0.582 HG21 HG11 ' B' ' 434' ' ' VAL . 48.8 mt -145.2 128.92 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.859 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 416' ' ' GLU . . . . . 0.421 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.8 108.8 18.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.746 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 417' ' ' ILE . . . . . 0.606 HG12 ' HB ' ' B' ' 432' ' ' ILE . 61.1 mt -128.53 108.59 19.03 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.643 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 418' ' ' PRO . . . . . 0.661 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.48 147.56 8.98 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.689 2.259 . . . . 0.0 112.903 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 419' ' ' ARG . . . . . 0.502 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.83 74.74 22.11 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.158 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -47.19 117.1 2.05 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.758 2.305 . . . . 0.0 112.475 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 421' ' ' VAL . . . . . 0.513 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.5 t -74.39 97.81 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.189 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.64 21.73 9.08 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.535 0.683 . . . . 0.0 109.29 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 423' ' ' GLY . . . . . 0.565 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.31 29.29 6.07 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.291 -179.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 424' ' ' VAL . . . . . 0.513 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.45 -37.51 30.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.17 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.85 35.78 4.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.793 0.33 . . . . 0.0 111.771 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 426' ' ' VAL . . . . . 0.651 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.32 -44.69 47.98 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.74 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 427' ' ' PRO . . . . . 0.651 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.9 Cg_endo -66.26 77.05 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.477 2.118 . . . . 0.0 111.102 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.34 -15.43 3.2 Favored Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.339 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.54 149.4 50.19 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.596 0.236 . . . . 0.0 110.729 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.5 -14.24 5.06 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.841 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.41 126.13 44.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.819 0.342 . . . . 0.0 111.024 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 432' ' ' ILE . . . . . 0.661 HG22 ' HD2' ' B' ' 418' ' ' PRO . 7.9 pt -131.04 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.264 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 433' ' ' PHE . . . . . 0.565 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.51 -176.4 2.81 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.981 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 434' ' ' VAL . . . . . 0.582 HG11 HG21 ' B' ' 415' ' ' ILE . 3.3 m -135.73 141.74 41.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.193 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 435' ' ' GLU . . . . . 0.471 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.37 108.48 17.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.778 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.78 168.32 12.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.256 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 437' ' ' THR . . . . . 0.608 HG23 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.91 -45.34 7.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.474 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.91 146.6 52.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.004 0.431 . . . . 0.0 111.215 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.22 -12.78 16.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.215 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.54 -54.79 26.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.086 0.469 . . . . 0.0 110.189 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -75.18 -29.54 60.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.789 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 442' ' ' CYS . . . . . 0.41 ' O ' ' HG2' ' B' ' 446' ' ' MET . 0.3 OUTLIER -62.13 -31.76 72.27 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.185 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.68 -48.08 15.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.611 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.58 -11.99 59.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.776 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.86 -55.9 3.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.939 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 446' ' ' MET . . . . . 0.527 ' O ' HG22 ' B' ' 450' ' ' THR . 1.9 ptp -62.87 -29.17 70.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.142 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -68.41 -16.2 63.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.603 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.63 -8.62 22.52 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.367 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.2 mt -95.69 -19.65 19.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.711 0.291 . . . . 0.0 110.925 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 450' ' ' THR . . . . . 0.527 HG22 ' O ' ' B' ' 446' ' ' MET . 39.9 p -70.02 132.22 45.56 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.087 175.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.31 -9.19 78.08 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.384 176.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -77.14 -152.2 0.04 OUTLIER 'General case' 0 C--O 1.232 0.153 0 CA-C-N 117.322 0.561 . . . . 0.0 110.517 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 453' ' ' LYS . . . . . 0.459 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.85 117.08 2.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.359 . . . . 0.0 111.324 -179.866 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.29 -36.36 75.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.494 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.21 -50.91 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.817 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 456' ' ' ASN . . . . . 0.504 ' HB3' ' SD ' ' A' ' 27' ' ' MET . 6.4 p30 -157.22 24.89 0.3 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.783 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 457' ' ' ARG . . . . . 0.403 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.45 136.54 19.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.253 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 8.2 p -56.47 140.17 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.994 176.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 50.7 t -101.73 121.67 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -174.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 460' ' ' VAL . . . . . 0.741 HG22 HG12 ' A' ' 53' ' ' ILE . 33.9 t -83.33 100.41 6.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.121 175.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 461' ' ' THR . . . . . 0.523 HG22 HD21 ' B' ' 380' ' ' LEU . 8.2 p -105.62 111.55 24.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.872 0.368 . . . . 0.0 110.94 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 462' ' ' LYS . . . . . 0.818 ' HG2' ' H ' ' A' ' 40' ' ' ILE . 31.7 mtmt -117.65 -164.59 1.01 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.28 0.562 . . . . 0.0 111.271 -177.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 463' ' ' TYR . . . . . 0.463 ' CD2' ' HE1' ' B' ' 446' ' ' MET . 1.2 m-85 -111.75 147.07 36.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.549 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 464' ' ' CYS . . . . . 0.442 ' O ' HG21 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.91 148.9 47.29 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.003 0.43 . . . . 0.0 111.373 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 465' ' ' ASP . . . . . 0.449 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.35 129.43 66.41 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.366 -179.858 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 466' ' ' PRO . . . . . 0.473 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.04 -33.4 73.19 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.782 2.321 . . . . 0.0 112.035 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.99 -58.53 7.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.396 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 468' ' ' SER . . . . . 0.461 ' H ' ' HG ' ' B' ' 468' ' ' SER . 0.8 OUTLIER -57.39 -33.76 68.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.26 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 469' ' ' TYR . . . . . 0.471 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.01 -51.27 70.38 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.162 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.39 -47.54 69.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 471' ' ' ARG . . . . . 0.443 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.64 -2.16 49.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.42 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.78 8.74 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.913 0.387 . . . . 0.0 110.223 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 473' ' ' ASP . . . . . 0.466 ' O ' ' HB2' ' B' ' 474' ' ' PHE . 0.3 OUTLIER -56.66 -20.13 19.88 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.981 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 474' ' ' PHE . . . . . 0.466 ' HB2' ' O ' ' B' ' 473' ' ' ASP . 3.3 m-30 72.92 32.67 1.34 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.331 0.652 . . . . 0.0 111.319 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 475' ' ' TRP . . . . . 0.406 ' HB2' ' SG ' ' B' ' 464' ' ' CYS . 14.0 t90 . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.626 -0.702 . . . . 0.0 111.614 178.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.7 ttm . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.785 0.326 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -91.12 102.68 15.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.162 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.1 p -123.76 -21.01 5.29 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.322 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 133.51 -20.62 4.13 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.978 -0.63 . . . . 0.0 112.012 -178.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -101.02 -42.2 6.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.799 0.333 . . . . 0.0 111.016 178.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -97.16 99.89 11.37 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.844 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -115.92 102.03 9.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.849 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.434 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 35.7 p -90.86 131.84 36.32 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.489 -178.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 5.2 Cg_exo -74.99 143.76 29.47 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.359 2.706 . . . . 0.0 112.933 -178.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 15.5 tp -117.56 134.31 55.0 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.288 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -124.47 -4.56 7.76 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -175.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -86.98 133.88 38.2 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.982 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.07 115.51 2.55 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.624 2.216 . . . . 0.0 112.378 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.05 -166.77 1.32 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.4 51.93 12.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.894 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.42 -36.19 3.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.952 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.75 91.9 2.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.9 -54.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.832 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.459 ' NH2' ' HB3' ' A' ' 74' ' ' PRO . 1.7 tpt180 -127.89 111.22 13.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.96 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.99 125.56 24.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.713 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.72 19.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.024 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . 0.542 ' HZ3' HG11 ' B' ' 459' ' ' VAL . 71.8 m95 -141.97 53.09 1.48 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.798 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.2 -156.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.858 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.473 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.36 -37.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.423 ' OD1' ' HB ' ' A' ' 33' ' ' ILE . 0.2 OUTLIER -114.71 120.6 40.64 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 118.956 -0.545 . . . . 0.0 110.598 179.961 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.464 HG21 ' HA3' ' A' ' 71' ' ' GLY . 81.0 p -93.18 -23.67 18.49 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 123.63 0.581 . . . . 0.0 111.238 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -87.94 169.9 11.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.607 177.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.74 139.87 56.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.724 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -68.04 116.33 8.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.347 0.594 . . . . 0.0 111.947 -176.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -153.01 -14.77 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.089 176.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.7 t -134.36 158.1 44.68 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.7 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.1 p -75.01 135.7 26.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-O 121.109 0.48 . . . . 0.0 111.039 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.467 HD13 ' HD2' ' A' ' 34' ' ' PRO . 2.4 tp -104.38 118.66 56.18 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.969 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.467 ' HD2' HD13 ' A' ' 33' ' ' ILE . 9.4 Cg_exo -71.27 117.12 4.99 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.565 2.176 . . . . 0.0 111.845 175.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -113.93 87.27 0.44 Allowed Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.919 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 94.5 mmm -71.33 129.71 88.64 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 120.573 0.225 . . . . 0.0 111.451 -178.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -60.0 146.03 96.97 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.89 2.394 . . . . 0.0 111.599 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.829 ' HG1' ' HA ' ' B' ' 460' ' ' VAL . 71.3 p -114.07 41.37 2.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.167 0.508 . . . . 0.0 110.815 -174.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.668 HG12 HG21 ' B' ' 450' ' ' THR . 3.1 m -104.75 116.99 49.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.774 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.876 HG23 ' HG2' ' A' ' 49' ' ' GLU . 6.3 mt -95.96 131.53 28.83 Favored Pre-proline 0 CA--C 1.536 0.411 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.338 -177.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.505 ' HB2' HD22 ' A' ' 44' ' ' LEU . 51.6 Cg_exo -55.87 156.78 18.21 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.901 3.067 . . . . 0.0 113.879 -177.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 19.2 Cg_exo -67.27 -29.87 38.18 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 123.641 2.894 . . . . 0.0 114.139 -176.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -95.35 49.47 1.89 Allowed Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.505 -0.855 . . . . 0.0 112.588 -177.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.505 HD22 ' HB2' ' A' ' 41' ' ' PRO . 1.1 mm? -117.82 152.69 34.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.723 0.297 . . . . 0.0 111.358 -174.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.504 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.6 p -95.12 156.62 16.24 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.159 175.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.412 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.21 -31.35 71.12 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 120.889 0.376 . . . . 0.0 111.301 -174.663 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.428 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.36 -45.13 61.22 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.23 -33.05 72.69 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.731 -177.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.876 ' HG2' HG23 ' A' ' 40' ' ' ILE . 44.5 mt-10 -60.55 -45.3 94.38 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.221 177.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.407 ' O ' HG23 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.05 -43.34 98.93 Favored 'General case' 0 C--O 1.185 -2.318 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.29 177.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.438 ' HA ' HG23 ' A' ' 54' ' ' VAL . . . -58.33 -40.77 83.01 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 123.771 0.669 . . . . 0.0 111.571 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -67.55 -46.48 72.63 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 122.175 -0.328 . . . . 0.0 110.759 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.733 HG13 HD12 ' A' ' 40' ' ' ILE . 87.2 mt -58.52 -51.16 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 110.751 176.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.438 HG23 ' HA ' ' A' ' 51' ' ' ALA . 35.0 m -66.67 -35.6 75.2 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.744 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.919 -175.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.16 -44.91 92.14 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.537 0.608 . . . . 0.0 110.312 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.465 ' HA ' ' HG2' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -70.15 -28.08 65.06 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.828 179.358 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.48 ' HB3' ' CD1' ' A' ' 112' ' ' LEU . 15.8 mt-30 -74.34 -38.49 63.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.231 174.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.475 HD11 HD11 ' A' ' 113' ' ' ILE . 72.7 mt -62.53 -47.04 94.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 114.871 -1.058 . . . . 0.0 110.374 178.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.465 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.4 -41.51 84.84 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.689 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -67.42 -34.36 77.08 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.257 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.524 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.18 -44.91 78.49 Favored 'General case' 0 C--O 1.207 -1.175 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 174.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 m -65.67 -35.72 81.58 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -178.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.46 ' O ' HG21 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.76 -42.8 75.98 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 122.111 0.958 . . . . 0.0 108.516 176.181 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.524 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.79 -47.73 83.84 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 113.797 -1.547 . . . . 0.0 111.898 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.21 -28.89 63.47 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.812 177.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -68.05 -47.06 69.38 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.46 HG21 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.52 14.45 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.971 -0.692 . . . . 0.0 112.846 -177.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.74 29.44 10.74 Favored Glycine 0 C--N 1.315 -0.592 0 C-N-CA 119.87 -1.157 . . . . 0.0 111.285 -177.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.44 90.05 6.68 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.163 0.506 . . . . 0.0 110.147 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.0 tp -92.73 -54.94 3.56 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 121.692 -0.63 . . . . 0.0 112.3 -170.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.464 ' HA3' HG21 ' A' ' 26' ' ' THR . . . 61.2 97.94 0.01 OUTLIER Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.079 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.414 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 10.7 pt -81.49 128.22 70.52 Favored Pre-proline 0 C--N 1.329 -0.313 0 O-C-N 122.569 -0.371 . . . . 0.0 111.986 -178.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.57 ' HG3' ' ND2' ' B' ' 456' ' ' ASN . 29.0 Cg_exo -62.94 135.47 51.72 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.124 2.549 . . . . 0.0 112.866 178.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.459 ' HB3' ' NH2' ' A' ' 19' ' ' ARG . 21.8 Cg_exo -66.87 131.35 25.38 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.141 2.561 . . . . 0.0 112.196 177.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -129.57 97.96 23.63 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.993 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.59 104.52 1.16 Allowed 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 123.215 2.61 . . . . 0.0 112.229 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 68.03 158.81 0.15 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.586 0.708 . . . . 0.0 112.373 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -119.52 164.33 15.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.688 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.8 mtt180 -74.8 -51.93 12.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.253 177.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.445 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 50.5 p -95.18 122.07 60.69 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.042 174.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 80' ' ' SER . 28.6 Cg_exo -61.82 129.89 29.25 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.774 2.316 . . . . 0.0 112.471 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.7 t -145.55 101.33 4.33 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.65 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -74.95 -20.55 16.87 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.696 2.264 . . . . 0.0 112.808 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.43 ' HA ' ' HD3' ' A' ' 85' ' ' PRO . 39.5 tt0 -139.35 116.49 8.58 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.963 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 84' ' ' GLU . 10.8 Cg_exo -71.43 107.92 2.26 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.803 2.335 . . . . 0.0 112.418 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.5 mt -90.6 110.6 22.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.558 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -148.0 140.23 24.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.261 -176.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -92.54 116.3 28.88 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.673 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.9 m -74.28 -38.76 63.3 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.537 -178.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 69.95 112.3 0.05 Allowed 'General case' 0 N--CA 1.47 0.546 0 O-C-N 123.8 0.687 . . . . 0.0 111.713 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -115.51 27.74 8.24 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.522 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -76.71 -51.64 11.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.939 0.4 . . . . 0.0 110.713 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -95.59 140.84 29.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.597 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.4 HD21 ' H ' ' A' ' 94' ' ' LEU . 1.7 pt? -74.21 -22.02 59.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.124 176.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -119.35 105.44 11.3 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.049 175.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -151.83 -50.2 0.11 Allowed 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -72.12 -52.46 16.64 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.27 -0.894 . . . . 0.0 109.7 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.5 mp0 -53.23 -51.76 61.12 Favored 'General case' 0 CA--C 1.502 -0.889 0 CA-C-N 113.612 -1.631 . . . . 0.0 110.702 -178.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.69 -38.69 87.28 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 113.428 -1.714 . . . . 0.0 110.632 -177.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.509 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.95 -44.5 94.34 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 123.154 0.284 . . . . 0.0 110.369 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.703 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.3 m -68.91 -50.11 52.3 Favored 'General case' 0 N--CA 1.428 -1.538 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.677 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.41 -41.3 93.78 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -175.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.04 -39.17 89.95 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 178.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.521 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.25 -40.11 89.13 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.703 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.3 mt -63.93 -41.04 97.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.679 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.05 -34.4 78.32 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.805 178.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.48 -34.33 74.19 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 177.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.48 -48.83 76.05 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 175.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.535 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.38 -45.48 94.2 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.352 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.3 -37.4 85.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 123.53 0.732 . . . . 0.0 111.027 -178.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.83 -43.72 85.99 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.48 ' CD1' ' HB3' ' A' ' 57' ' ' GLN . 65.7 mt -72.2 -38.63 68.99 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.771 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.535 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.36 -50.86 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 CA-C-O 120.538 0.208 . . . . 0.0 110.552 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.8 m -60.72 -39.53 88.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.289 0.566 . . . . 0.0 110.529 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.594 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.54 61.12 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.024 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.34 -37.15 84.68 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -177.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.8 t -65.58 -36.83 78.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.74 80.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.245 0.545 . . . . 0.0 110.248 177.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.6 mt -71.43 -40.59 70.33 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.055 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -133.62 111.15 12.47 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.011 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.68 -22.72 37.14 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.819 2.346 . . . . 0.0 112.577 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.28 0.04 56.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.137 -177.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.89 134.64 54.44 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.627 -178.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -105.37 109.23 62.97 Favored Pre-proline 0 CA--C 1.51 -0.583 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.211 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.32 157.88 59.94 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.293 1.995 . . . . 0.0 111.553 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.63 154.51 25.14 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 123.603 2.869 . . . . 0.0 111.711 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.03 -28.46 67.41 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -173.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -73.6 -8.62 56.71 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.728 0.642 . . . . 0.0 111.868 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -68.97 131.5 45.18 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 176.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 131' ' ' PRO . 47.9 mmtm -113.47 118.19 43.89 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-O 120.767 0.318 . . . . 0.0 111.795 -176.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 130' ' ' LYS . 6.5 Cg_exo -75.16 167.6 26.54 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.286 2.657 . . . . 0.0 111.766 174.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -80.93 32.06 0.51 Allowed 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.555 2.17 . . . . 0.0 113.089 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . 65.24 -175.87 0.18 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.258 0.623 . . . . 0.0 112.163 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 2.9 m -127.04 -14.75 5.46 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.89 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 135' ' ' ARG . 44.9 mtm-85 -74.5 105.42 5.62 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.159 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 53.8 t -124.25 128.85 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.64 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 42.5 t -74.71 -69.6 0.45 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.919 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -133.84 129.87 37.1 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.582 177.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.46 ' HD3' ' H ' ' A' ' 139' ' ' LYS . 0.0 OUTLIER -127.87 -29.98 2.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.075 -179.649 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 3.0 m -104.89 121.58 56.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.001 0.429 . . . . 0.0 110.91 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 65.6 mtt -101.32 144.77 29.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.023 -178.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.433 ' HB ' ' HD2' ' A' ' 143' ' ' PRO . 43.1 pt -95.87 158.1 34.82 Favored Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.069 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' PRO . . . . . 0.433 ' HD2' ' HB ' ' A' ' 142' ' ' ILE . 32.7 Cg_endo -65.01 140.2 64.85 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.694 2.263 . . . . 0.0 112.527 178.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 59.4 tp60 -93.78 129.97 39.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.882 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 17.4 t70 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.044 -0.979 . . . . 0.0 111.177 179.919 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 CA-C-O 120.039 -0.312 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 41.7 t-80 64.28 104.22 0.03 OUTLIER Pre-proline 0 N--CA 1.47 0.55 0 C-N-CA 123.192 0.597 . . . . 0.0 111.349 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -68.74 132.8 25.85 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.924 2.416 . . . . 0.0 113.662 -177.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 375' ' ' THR . . . . . 0.452 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -117.78 -71.32 0.74 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.168 174.196 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 376' ' ' GLU . . . . . 0.475 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.88 0.01 OUTLIER 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.071 0.396 . . . . 0.0 112.071 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 377' ' ' VAL . . . . . 0.453 HG21 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.64 150.97 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.112 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.448 -179.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 378' ' ' LEU . . . . . 0.459 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.65 152.51 20.83 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.179 -179.052 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 379' ' ' CYS . . . . . 0.567 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.49 142.5 46.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.636 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . 0.433 HD11 HG11 ' B' ' 434' ' ' VAL . 5.3 mt -132.73 101.64 5.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.897 0.379 . . . . 0.0 111.046 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 381' ' ' MET . . . . . 0.478 ' O ' HG23 ' B' ' 459' ' ' VAL . 27.0 ttp -117.97 165.13 14.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.604 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 382' ' ' ASN . . . . . 0.452 HD22 HE21 ' A' ' 57' ' ' GLN . 13.4 t30 58.85 51.19 7.69 Favored 'General case' 0 C--N 1.34 0.158 0 O-C-N 123.508 0.505 . . . . 0.0 111.387 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 383' ' ' MET . . . . . 0.412 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.85 14.38 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.228 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 384' ' ' VAL . . . . . 0.494 HG21 HG21 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.29 125.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.885 0.374 . . . . 0.0 111.315 179.878 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.76 151.72 43.05 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.402 179.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.15 -23.44 73.11 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.317 2.011 . . . . 0.0 112.297 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.91 -5.49 53.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.52 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.03 -36.77 5.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.911 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 389' ' ' LEU . . . . . 0.465 HD13 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.94 34.92 0.46 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.984 0.421 . . . . 0.0 110.684 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 390' ' ' LEU . . . . . 0.524 HD21 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.51 -15.7 5.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.695 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.41 148.72 23.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.521 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -73.52 -30.28 63.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.176 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.28 -47.73 26.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.69 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.58 -44.3 91.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.71 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.33 -59.39 5.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.184 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.26 61.56 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.202 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.2 -41.05 67.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.39 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 398' ' ' ILE . . . . . 0.48 HD13 HG13 ' B' ' 384' ' ' VAL . 65.4 mt -74.91 -53.65 16.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.5 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 399' ' ' VAL . . . . . 0.578 HG22 HD13 ' B' ' 417' ' ' ILE . 59.8 t -53.28 -46.96 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.805 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.46 -59.97 3.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.517 -179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.64 -57.18 11.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.356 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.12 -32.83 15.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.361 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 403' ' ' ARG . . . . . 0.431 ' HA ' HD13 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.22 -57.38 4.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.165 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.91 -33.64 64.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.198 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 405' ' ' GLU . . . . . 0.527 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.46 -47.03 44.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.963 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.84 -24.0 67.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.154 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.04 30.34 1.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.957 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.07 -17.16 12.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.93 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.72 -15.39 14.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.503 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.13 -139.43 4.16 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.574 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.26 132.46 56.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.726 0.298 . . . . 0.0 111.079 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 412' ' ' VAL . . . . . . . . . . . . . 7.5 p -117.38 115.46 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.052 0.453 . . . . 0.0 110.6 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . 0.605 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.62 -62.04 2.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.136 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.98 -169.36 3.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.147 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 415' ' ' ILE . . . . . 0.624 HG23 HG12 ' B' ' 434' ' ' VAL . 48.2 mt -145.1 128.97 12.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.876 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 416' ' ' GLU . . . . . 0.42 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.88 108.83 18.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.674 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 417' ' ' ILE . . . . . 0.609 HG12 ' HB ' ' B' ' 432' ' ' ILE . 60.5 mt -128.58 108.5 18.94 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.663 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 418' ' ' PRO . . . . . 0.668 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.47 147.62 8.9 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.621 2.214 . . . . 0.0 112.886 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 419' ' ' ARG . . . . . 0.524 HH21 HD21 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.91 74.74 21.82 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.141 179.841 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -47.17 117.08 2.03 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.729 2.286 . . . . 0.0 112.497 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 421' ' ' VAL . . . . . 0.521 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.0 t -74.44 97.86 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.128 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.59 21.77 9.04 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.559 0.695 . . . . 0.0 109.358 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 423' ' ' GLY . . . . . 0.54 ' HA2' HG21 ' B' ' 426' ' ' VAL . . . 102.25 29.31 6.09 Favored Glycine 0 N--CA 1.444 -0.819 0 CA-C-N 114.79 -1.096 . . . . 0.0 111.306 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 424' ' ' VAL . . . . . 0.521 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.51 -37.5 30.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.152 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.92 35.93 4.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.777 0.323 . . . . 0.0 111.741 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 426' ' ' VAL . . . . . 0.646 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.37 -44.68 47.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.759 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 427' ' ' PRO . . . . . 0.646 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.34 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.488 2.125 . . . . 0.0 111.05 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.3 -15.37 3.22 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.341 -178.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.54 149.31 50.31 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.649 0.261 . . . . 0.0 110.743 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.61 -14.31 5.03 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.838 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 126.06 44.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.839 0.352 . . . . 0.0 111.111 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 432' ' ' ILE . . . . . 0.668 HG22 ' HD2' ' B' ' 418' ' ' PRO . 7.8 pt -130.96 172.91 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.252 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 433' ' ' PHE . . . . . 0.567 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.37 2.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.986 0.422 . . . . 0.0 111.966 -178.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 434' ' ' VAL . . . . . 0.624 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.79 141.72 41.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.179 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 435' ' ' GLU . . . . . 0.479 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.39 108.47 17.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.836 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.74 168.35 12.56 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.205 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 437' ' ' THR . . . . . 0.605 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.96 -45.36 7.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.458 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.93 146.54 52.16 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.041 0.448 . . . . 0.0 111.25 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.14 -12.8 16.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.26 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -54.89 25.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.141 0.496 . . . . 0.0 110.121 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -75.06 -29.53 60.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.858 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -31.79 72.35 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.094 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.63 -48.08 15.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.611 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.54 -12.1 59.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.753 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -55.69 3.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.96 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 446' ' ' MET . . . . . 0.572 ' O ' HG22 ' B' ' 450' ' ' THR . 3.6 ptm -63.74 -28.15 69.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.038 -179.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.06 -16.28 63.66 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.54 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.56 -8.62 22.64 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.487 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.3 mt -95.73 -19.87 19.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.739 0.304 . . . . 0.0 110.909 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 450' ' ' THR . . . . . 0.703 ' HB ' ' H ' ' A' ' 38' ' ' THR . 43.2 p -70.02 131.74 44.83 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.884 175.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.81 -9.46 76.74 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.531 177.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 452' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -77.15 -152.16 0.04 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 117.252 0.526 . . . . 0.0 110.505 179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 453' ' ' LYS . . . . . 0.473 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.84 117.01 2.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.855 0.359 . . . . 0.0 111.34 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.17 -36.41 75.26 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.538 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.817 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 456' ' ' ASN . . . . . 0.57 ' ND2' ' HG3' ' A' ' 73' ' ' PRO . 6.4 p30 -157.32 24.84 0.3 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.817 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 457' ' ' ARG . . . . . 0.412 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.46 134.58 18.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.294 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 6.6 p -66.3 129.69 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.871 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 459' ' ' VAL . . . . . 0.542 HG11 ' HZ3' ' A' ' 22' ' ' TRP . 2.0 p -94.48 122.98 46.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.521 -175.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 460' ' ' VAL . . . . . 0.829 ' HA ' ' HG1' ' A' ' 38' ' ' THR . 41.2 t -92.53 92.91 3.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.35 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 76.7 p -83.32 142.67 30.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.301 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 462' ' ' LYS . . . . . 0.647 ' HZ2' ' H ' ' A' ' 40' ' ' ILE . 1.3 ttmm -139.01 -164.18 1.61 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.2 0.524 . . . . 0.0 111.337 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.73 146.95 37.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.512 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 464' ' ' CYS . . . . . 0.453 ' O ' HG21 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 148.99 47.45 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.999 0.428 . . . . 0.0 111.456 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 465' ' ' ASP . . . . . 0.452 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.35 129.39 66.6 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.337 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 466' ' ' PRO . . . . . 0.475 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.12 -33.22 73.26 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.655 2.236 . . . . 0.0 112.103 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.07 -58.39 8.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.453 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.51 -33.74 68.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.233 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 469' ' ' TYR . . . . . 0.479 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.07 -51.19 70.69 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.209 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.4 -47.49 69.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.332 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 471' ' ' ARG . . . . . 0.448 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.73 -2.11 49.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.399 -179.886 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.07 20.78 8.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.905 0.383 . . . . 0.0 110.285 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 473' ' ' ASP . . . . . 0.51 ' O ' ' HB2' ' B' ' 474' ' ' PHE . 0.3 OUTLIER -56.75 -20.48 22.39 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.959 179.927 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 474' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' B' ' 473' ' ' ASP . 2.8 m-30 77.09 -67.74 0.2 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.967 0.907 . . . . 0.0 111.582 -178.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.447 -0.787 . . . . 0.0 111.0 -178.424 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 . . . . . 0 CA--C 1.527 0.074 0 N-CA-C 110.154 -0.314 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -56.66 115.57 2.57 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.998 2.465 . . . . 0.0 112.34 -177.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.73 1.32 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.833 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.88 12.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.38 -36.22 3.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.984 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.74 91.89 2.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.894 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.89 -54.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.838 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.85 111.21 13.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.973 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.02 125.58 24.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.755 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.76 19.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.009 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.544 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.9 m95 -141.97 53.02 1.48 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.782 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.23 -156.57 0.13 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.879 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.478 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.27 -37.72 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.87 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.76 122.69 47.17 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.593 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.373 0 O-C-N 124.03 0.831 . . . . 0.0 110.399 176.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 C--O 1.232 0.145 0 CA-C-O 121.219 0.533 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.464 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 71.5 p -119.1 162.3 18.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.159 176.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.526 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.72 -31.42 72.34 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 120.896 0.379 . . . . 0.0 111.334 -178.239 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.464 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.3 -45.21 61.01 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.08 -33.45 73.55 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.749 -177.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.22 -46.32 88.77 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.998 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.554 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.18 -43.36 98.44 Favored 'General case' 0 C--O 1.185 -2.316 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.229 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.545 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.39 -41.41 84.81 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.765 0.666 . . . . 0.0 111.602 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -66.99 -42.79 84.44 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.024 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.691 HG23 HG21 ' B' ' 460' ' ' VAL . 96.6 mt -66.25 -49.14 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.768 177.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -65.57 -35.65 75.75 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.931 -176.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.11 -44.39 91.99 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.491 0.587 . . . . 0.0 110.372 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.3 tp -62.67 -42.01 99.39 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.807 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.527 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 40.1 mt-30 -68.78 -35.67 77.34 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.641 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.485 HD13 HD13 ' A' ' 113' ' ' ILE . 73.3 mt -62.83 -47.0 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.431 178.48 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.35 -41.81 84.52 Favored 'General case' 0 CA--C 1.513 -0.47 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.701 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.26 -33.15 73.83 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.441 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.1 -44.94 78.72 Favored 'General case' 0 C--O 1.207 -1.159 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 173.528 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.0 m -65.55 -35.79 81.88 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.72 -42.83 75.89 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 122.089 0.947 . . . . 0.0 108.531 176.173 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.2 ttmt -61.75 -47.75 83.8 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 113.773 -1.558 . . . . 0.0 111.921 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.17 -28.89 63.51 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.788 -0.765 . . . . 0.0 111.863 177.01 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.95 -47.16 69.41 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.1 -17.52 14.46 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.966 -0.694 . . . . 0.0 112.853 -177.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.45 10.76 Favored Glycine 0 C--N 1.316 -0.53 0 C-N-CA 119.857 -1.163 . . . . 0.0 111.268 -177.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.43 91.37 6.84 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.233 0.539 . . . . 0.0 110.171 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.4 tp . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 178.672 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.435 -1.186 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.1 -52.58 16.12 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.257 -0.902 . . . . 0.0 109.661 -178.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.466 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.5 mp0 -53.23 -51.77 61.1 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.623 -1.626 . . . . 0.0 110.667 -178.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -66.68 -38.68 87.29 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 113.466 -1.697 . . . . 0.0 110.659 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.535 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.9 -44.54 94.19 Favored 'General case' 0 CA--C 1.511 -0.538 0 O-C-N 123.22 0.325 . . . . 0.0 110.402 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.722 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.4 m -68.95 -50.07 52.42 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.703 178.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.455 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.34 -41.37 93.99 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.99 -39.15 90.08 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 100' ' ' ARG . 6.2 tmtt? -60.19 -40.11 88.9 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.98 -41.05 97.64 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.657 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.02 -34.33 78.18 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.824 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.37 74.3 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 177.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.43 -48.86 76.03 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 175.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.552 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.29 -45.53 94.09 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.405 179.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.21 -37.42 85.28 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.564 0.746 . . . . 0.0 111.044 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.84 -43.75 86.07 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.433 HD13 ' HB2' ' A' ' 57' ' ' GLN . 65.6 mt -72.22 -38.58 68.96 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.768 177.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.47 -50.87 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 110.489 -0.189 . . . . 0.0 110.489 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.7 m -60.68 -39.5 88.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.277 0.561 . . . . 0.0 110.557 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.612 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.94 -49.6 60.86 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.005 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.37 -37.12 84.57 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.8 t -65.53 -36.81 78.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.17 0.509 . . . . 0.0 109.644 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.73 80.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.23 0.538 . . . . 0.0 110.25 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.6 mt -71.45 -40.61 70.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.023 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.63 111.2 12.47 Favored Pre-proline 0 C--N 1.317 -0.826 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.936 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.74 -22.66 36.88 Favored 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 122.8 2.334 . . . . 0.0 112.57 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.34 0.13 55.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.101 -177.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.97 134.68 54.44 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.616 -178.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.41 109.11 62.83 Favored Pre-proline 0 CA--C 1.509 -0.614 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.274 177.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.24 157.89 59.85 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 122.303 2.002 . . . . 0.0 111.485 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.55 154.51 24.73 Favored 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 123.603 2.868 . . . . 0.0 111.777 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.06 -32.41 72.74 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 -173.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -73.82 -24.92 59.86 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 123.895 0.747 . . . . 0.0 110.951 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 46.1 t80 . . . . . 0 N--CA 1.454 -0.256 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.295 175.21 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo . . . . . 0 N--CA 1.473 0.284 0 CA-C-O 121.411 0.505 . . . . 0.0 113.358 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 375' ' ' THR . . . . . 0.462 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -117.77 -71.38 0.74 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.119 179.892 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 376' ' ' GLU . . . . . 0.495 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.91 0.01 OUTLIER 'General case' 0 C--O 1.232 0.136 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 377' ' ' VAL . . . . . 0.565 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.66 150.97 7.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.431 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 378' ' ' LEU . . . . . 0.483 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.59 152.51 20.86 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.246 -179.086 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 379' ' ' CYS . . . . . 0.59 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.55 142.61 46.49 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.567 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.513 HD11 HG13 ' B' ' 434' ' ' VAL . 5.4 mt -132.79 103.13 5.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.968 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 10.3 ttt -116.86 162.79 17.17 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.194 -176.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.58 51.25 8.09 Favored 'General case' 0 C--N 1.342 0.262 0 O-C-N 123.208 0.318 . . . . 0.0 111.275 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 383' ' ' MET . . . . . 0.433 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.92 14.39 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.259 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 384' ' ' VAL . . . . . 0.707 HG21 HG23 ' B' ' 432' ' ' ILE . 0.4 OUTLIER -152.3 125.11 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.83 0.347 . . . . 0.0 111.354 179.863 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.69 151.77 43.04 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.428 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.12 -23.53 73.29 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.307 2.005 . . . . 0.0 112.315 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.85 -5.48 53.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.559 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.07 -36.7 5.78 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.901 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 389' ' ' LEU . . . . . 0.474 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.91 0.46 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 390' ' ' LEU . . . . . 0.55 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.53 -15.73 5.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.663 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -98.28 148.77 23.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.574 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -73.52 -30.26 62.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.21 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -75.37 -47.65 26.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.728 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.57 -44.27 91.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.768 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -56.4 -59.34 5.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.249 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.3 61.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.194 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.1 -41.04 67.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.412 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 398' ' ' ILE . . . . . 0.498 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.89 -53.67 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.517 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 399' ' ' VAL . . . . . 0.611 HG22 HD12 ' B' ' 417' ' ' ILE . 59.6 t -53.34 -46.91 58.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.814 -179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.99 3.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.486 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.63 -57.13 11.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.389 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.15 -32.9 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.33 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 403' ' ' ARG . . . . . 0.451 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.2 -57.41 4.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.706 0.288 . . . . 0.0 111.116 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.98 -33.57 64.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.162 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 405' ' ' GLU . . . . . 0.544 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.5 -47.04 44.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.942 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.89 -23.88 67.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.144 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.12 30.38 1.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.961 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.13 -17.17 12.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.863 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.41 14.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.574 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.14 -139.4 4.14 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.586 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.22 132.4 56.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.678 0.275 . . . . 0.0 111.101 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 412' ' ' VAL . . . . . 0.424 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.36 115.43 48.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.01 0.433 . . . . 0.0 110.692 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 413' ' ' LYS . . . . . 0.68 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.63 -61.95 2.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.186 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.02 -169.4 3.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.088 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 415' ' ' ILE . . . . . 0.611 HG23 HG12 ' B' ' 434' ' ' VAL . 48.7 mt -145.12 128.98 12.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.833 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 416' ' ' GLU . . . . . 0.43 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.87 108.8 18.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.667 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 417' ' ' ILE . . . . . 0.955 HG23 HG21 ' B' ' 432' ' ' ILE . 60.9 mt -128.56 108.6 18.99 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.625 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 418' ' ' PRO . . . . . 0.634 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.6 Cg_endo -48.56 147.65 9.11 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.667 2.245 . . . . 0.0 112.866 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 419' ' ' ARG . . . . . 0.55 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.93 74.73 21.73 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.149 179.854 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -47.15 117.05 2.0 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.728 2.285 . . . . 0.0 112.491 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 421' ' ' VAL . . . . . 0.598 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.2 t -74.36 97.77 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.186 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.65 21.77 9.14 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.479 0.657 . . . . 0.0 109.32 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 423' ' ' GLY . . . . . 0.617 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.26 29.26 6.1 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.328 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 424' ' ' VAL . . . . . 0.598 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.51 -37.45 30.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.94 35.9 4.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 111.776 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 426' ' ' VAL . . . . . 0.678 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.33 -44.74 48.12 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.783 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 427' ' ' PRO . . . . . 0.678 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.29 77.08 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.497 2.131 . . . . 0.0 111.095 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.3 -15.39 3.22 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.359 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.3 t -67.54 149.38 50.22 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.573 0.225 . . . . 0.0 110.82 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.51 -14.2 5.06 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.814 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.43 126.13 44.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.871 0.367 . . . . 0.0 111.092 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 432' ' ' ILE . . . . . 0.955 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -131.05 172.87 15.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.232 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 433' ' ' PHE . . . . . 0.59 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.33 2.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.958 0.409 . . . . 0.0 112.015 -178.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 434' ' ' VAL . . . . . 0.611 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.86 141.68 41.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.18 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 435' ' ' GLU . . . . . 0.492 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.31 108.48 17.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.841 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.7 168.42 12.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.234 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 437' ' ' THR . . . . . 0.68 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -95.02 -45.34 7.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.439 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.94 146.62 52.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 111.198 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.26 -12.7 16.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.248 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.9 24.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.098 0.475 . . . . 0.0 110.078 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -75.07 -29.52 60.71 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.842 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.16 -31.74 72.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.209 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -78.72 -47.99 15.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.622 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.1 59.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.709 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.79 -55.76 3.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 446' ' ' MET . . . . . 0.468 ' HB3' HD21 ' B' ' 378' ' ' LEU . 4.2 ptm -63.64 -27.7 69.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.297 -179.753 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.51 -16.26 63.41 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.632 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.65 -8.58 22.52 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.374 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 449' ' ' LEU . . . . . 0.401 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.71 -19.02 20.02 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.813 0.34 . . . . 0.0 110.969 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 3.6 t -74.37 131.1 40.82 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.989 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.53 -9.65 73.73 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.23 178.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 452' ' ' ARG . . . . . 0.431 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -76.41 -152.23 0.04 OUTLIER 'General case' 0 C--N 1.339 0.133 0 CA-C-N 117.327 0.564 . . . . 0.0 110.495 178.495 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 453' ' ' LYS . . . . . 0.478 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.79 117.12 2.29 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.811 0.338 . . . . 0.0 111.292 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.2 -36.4 75.29 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.545 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.824 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.29 24.93 0.3 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.771 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 457' ' ' ARG . . . . . 0.426 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.5 135.3 18.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.279 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 46.3 t -63.38 122.44 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.42 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 59.4 t -76.62 121.28 28.49 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.714 -177.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 460' ' ' VAL . . . . . 0.691 HG21 HG23 ' A' ' 53' ' ' ILE . 65.5 t -89.79 96.94 6.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.364 176.015 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 10.3 t -91.04 153.54 20.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.661 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 462' ' ' LYS . . . . . 0.407 ' HE3' ' HB3' ' B' ' 462' ' ' LYS . 2.0 ttpp -159.18 -167.52 2.09 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 121.106 0.479 . . . . 0.0 110.76 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -114.21 146.99 39.65 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 123.385 0.674 . . . . 0.0 110.452 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 464' ' ' CYS . . . . . 0.565 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.91 149.02 47.36 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.104 0.478 . . . . 0.0 111.286 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 465' ' ' ASP . . . . . 0.462 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.39 129.34 66.67 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.372 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 466' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.04 -33.32 72.84 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.75 2.3 . . . . 0.0 112.097 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.97 -58.52 7.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.441 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.36 -33.78 68.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.336 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 469' ' ' TYR . . . . . 0.492 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.0 -51.27 70.39 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.21 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.36 -47.51 69.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.367 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 471' ' ' ARG . . . . . 0.442 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.13 49.35 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.44 -179.925 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.73 8.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.942 0.401 . . . . 0.0 110.269 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 473' ' ' ASP . . . . . 0.442 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.81 -20.54 23.17 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.006 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 . . . . . 0 N--CA 1.476 0.836 0 C-N-CA 122.92 0.488 . . . . 0.0 112.017 179.027 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.414 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 67.3 m-85 . . . . . 0 C--O 1.231 0.091 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 38.8 Cg_exo -56.38 115.48 2.5 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 123.1 2.533 . . . . 0.0 112.458 -174.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.71 1.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.846 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.38 51.93 12.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.913 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.37 -36.24 3.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.992 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.71 91.86 2.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.86 -54.26 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.83 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.79 111.2 13.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.039 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.05 125.6 25.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.693 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 21' ' ' ARG . 0.9 OUTLIER -112.58 12.75 19.92 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.01 -179.805 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.554 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.9 m95 -141.98 53.11 1.48 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.731 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -156.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.84 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.477 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.37 -37.6 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.91 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.65 113.49 24.41 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.246 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.8 t . . . . . 0 N--CA 1.477 0.886 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -175.317 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.655 0.264 . . . . 0.0 111.593 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 48.5 p -77.56 157.92 30.1 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 173.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.613 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -63.36 -31.32 72.44 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 120.856 0.36 . . . . 0.0 111.319 -173.511 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -72.38 -45.04 61.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.3 -32.83 72.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.735 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.613 ' HG2' ' O ' ' A' ' 46' ' ' ARG . 20.2 pt-20 -66.84 -38.3 86.13 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.028 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.559 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.99 -43.34 96.01 Favored 'General case' 0 C--O 1.185 -2.338 0 CA-C-O 118.877 -0.583 . . . . 0.0 110.25 174.443 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.537 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.43 -41.95 86.21 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 123.794 0.684 . . . . 0.0 111.597 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -64.21 -48.12 77.08 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.834 175.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.699 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 63.5 mt -60.61 -51.8 68.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 120.872 0.368 . . . . 0.0 110.802 177.178 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.559 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -64.77 -35.62 75.48 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.789 0 CA-C-O 118.67 -0.681 . . . . 0.0 111.919 -174.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.01 -44.31 91.66 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.566 0.621 . . . . 0.0 110.317 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 2.2 pp -71.35 -28.19 63.89 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.884 179.298 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.619 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 14.2 mm-40 -74.51 -36.25 63.22 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 174.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.48 HD13 HD13 ' A' ' 113' ' ' ILE . 72.9 mt -63.21 -46.97 94.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.404 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.49 -40.86 85.22 Favored 'General case' 0 CA--C 1.513 -0.476 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.7 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -71.67 -30.25 65.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.321 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.542 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.51 -44.93 77.22 Favored 'General case' 0 C--O 1.208 -1.131 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 171.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.62 -35.79 81.82 Favored 'General case' 0 N--CA 1.432 -1.343 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.5 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.84 -42.7 76.16 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 176.163 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.542 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.81 -47.82 83.38 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 113.856 -1.52 . . . . 0.0 111.848 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.416 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.12 -28.91 63.58 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.883 177.024 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -67.98 -47.14 69.38 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.5 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.1 -17.49 14.47 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.916 0.709 . . . . 0.0 112.916 -177.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.47 10.73 Favored Glycine 0 C--N 1.316 -0.565 0 C-N-CA 119.884 -1.151 . . . . 0.0 111.29 -177.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.39 91.42 6.83 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.229 0.538 . . . . 0.0 110.24 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.626 177.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.436 -1.154 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.1 -52.5 16.47 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.226 -0.922 . . . . 0.0 109.659 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.461 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.4 mp0 -53.32 -51.7 61.55 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 113.677 -1.602 . . . . 0.0 110.659 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -66.73 -38.63 87.05 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.498 -1.683 . . . . 0.0 110.678 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.95 -44.55 94.33 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.177 0.298 . . . . 0.0 110.307 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.704 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.8 m -69.01 -49.99 52.77 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.691 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.454 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.43 -41.28 93.7 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -175.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.0 -39.07 89.98 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.533 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.29 -40.14 89.41 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.91 -41.01 97.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.736 178.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.11 -34.35 78.19 Favored 'General case' 0 C--O 1.21 -1.009 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.712 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.44 -34.34 74.27 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 177.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.54 -48.75 76.24 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 175.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.552 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.35 -45.51 94.08 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.392 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.27 -37.37 85.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.017 -178.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.91 -43.7 86.34 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 177.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.488 HD13 ' HB2' ' A' ' 57' ' ' GLN . 65.4 mt -72.28 -38.53 68.77 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.75 177.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.38 -50.85 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 120.514 0.197 . . . . 0.0 110.544 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 96.2 m -60.81 -39.46 89.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.148 0.499 . . . . 0.0 110.477 -179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.611 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.57 60.93 Favored 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.03 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.32 -37.08 84.56 Favored 'General case' 0 C--O 1.217 -0.621 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.0 t -65.59 -36.88 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.59 -40.76 80.35 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.162 0.505 . . . . 0.0 110.211 177.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 67.0 mt -71.49 -40.61 70.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.995 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ASN . . . . . 0.405 ' HA ' ' HD2' ' A' ' 121' ' ' PRO . 45.5 t30 -133.56 111.14 12.54 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.001 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 120' ' ' ASN . 59.7 Cg_endo -68.72 -22.69 36.94 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 122.805 2.337 . . . . 0.0 112.56 -178.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.33 0.14 55.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.336 0.589 . . . . 0.0 111.121 -177.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.96 134.61 54.31 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.651 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.32 109.16 62.89 Favored Pre-proline 0 N--CA 1.446 -0.642 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.332 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.28 157.98 59.49 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.228 1.952 . . . . 0.0 111.473 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.66 154.47 25.47 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 123.598 2.865 . . . . 0.0 111.737 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.06 -30.25 69.4 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -173.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -73.59 -25.27 60.26 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.851 0.719 . . . . 0.0 111.791 -174.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 42.4 t80 . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.723 0.297 . . . . 0.0 110.39 177.952 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo . . . . . 0 CA--C 1.53 0.309 0 N-CA-C 113.586 0.571 . . . . 0.0 113.586 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 375' ' ' THR . . . . . 0.463 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -129.01 -71.32 0.64 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.121 176.883 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 376' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.88 -45.92 0.01 OUTLIER 'General case' 0 C--O 1.232 0.172 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 377' ' ' VAL . . . . . 0.565 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.72 151.02 7.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.423 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 378' ' ' LEU . . . . . 0.472 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.7 152.57 20.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.207 -179.014 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 379' ' ' CYS . . . . . 0.602 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.7 t -115.56 142.61 46.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.641 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.51 HD11 HG13 ' B' ' 434' ' ' VAL . 5.4 mt -132.73 101.49 5.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.979 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 67.2 mtt -116.95 165.7 13.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.911 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.38 51.16 8.53 Favored 'General case' 0 CA--C 1.529 0.152 0 O-C-N 123.609 0.568 . . . . 0.0 111.324 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 383' ' ' MET . . . . . 0.442 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.87 14.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.235 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 384' ' ' VAL . . . . . 0.745 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.36 125.08 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.349 . . . . 0.0 111.369 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.415 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.69 151.72 43.01 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.412 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.1 -23.44 73.42 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.306 2.004 . . . . 0.0 112.342 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.93 -5.47 53.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.504 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.04 -36.8 5.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 389' ' ' LEU . . . . . 0.471 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.96 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.55 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 390' ' ' LEU . . . . . 0.557 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.54 -15.74 5.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.676 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -98.33 148.76 23.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.555 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -73.56 -30.26 62.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.218 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.39 -47.58 26.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.794 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.54 -44.27 91.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.795 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.43 -59.33 5.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -27.33 61.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.08 -41.09 67.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.418 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 398' ' ' ILE . . . . . 0.497 HD13 HG12 ' B' ' 384' ' ' VAL . 65.6 mt -74.86 -53.74 15.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.491 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 399' ' ' VAL . . . . . 0.622 HG22 HD12 ' B' ' 417' ' ' ILE . 59.8 t -53.28 -46.91 57.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.85 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.43 -59.99 3.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.5 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.65 -57.19 11.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.39 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.12 -32.85 15.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.333 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 403' ' ' ARG . . . . . 0.459 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.2 -57.43 4.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 111.141 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.94 -33.61 64.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.205 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 405' ' ' GLU . . . . . 0.554 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.44 -47.08 44.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.001 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.78 -24.04 67.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.137 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.33 1.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.97 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.04 -17.17 12.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -106.68 -15.38 14.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.594 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.15 -139.46 4.17 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.616 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 411' ' ' LEU . . . . . 0.417 ' HA ' HD13 ' B' ' 411' ' ' LEU . 1.6 mm? -114.21 132.5 56.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.645 0.259 . . . . 0.0 111.11 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 412' ' ' VAL . . . . . 0.423 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.41 115.37 48.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.007 0.432 . . . . 0.0 110.631 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 413' ' ' LYS . . . . . 0.703 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.59 -62.0 2.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.225 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.95 -169.35 3.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.109 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 415' ' ' ILE . . . . . 0.616 HG23 HG12 ' B' ' 434' ' ' VAL . 48.7 mt -145.13 128.99 12.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.842 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 416' ' ' GLU . . . . . 0.423 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.8 108.76 18.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.712 179.791 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 417' ' ' ILE . . . . . 1.018 HG23 HG21 ' B' ' 432' ' ' ILE . 60.7 mt -128.56 108.53 18.98 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.725 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 418' ' ' PRO . . . . . 0.631 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.45 147.61 8.85 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.664 2.243 . . . . 0.0 112.965 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 419' ' ' ARG . . . . . 0.557 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.9 74.72 21.88 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.145 179.891 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.2 117.15 2.08 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.749 2.3 . . . . 0.0 112.434 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 421' ' ' VAL . . . . . 0.599 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 95.9 t -74.44 97.82 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.171 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.59 21.77 9.05 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.596 0.713 . . . . 0.0 109.353 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 423' ' ' GLY . . . . . 0.649 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.27 29.28 6.09 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.232 -179.018 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 424' ' ' VAL . . . . . 0.599 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.48 -37.49 30.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.94 35.81 4.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.787 0.327 . . . . 0.0 111.774 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 426' ' ' VAL . . . . . 0.671 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.26 -44.75 48.97 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.827 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 427' ' ' PRO . . . . . 0.671 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.2 Cg_endo -66.32 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.443 2.095 . . . . 0.0 111.078 179.482 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.29 -15.4 3.22 Favored Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.306 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.59 149.34 50.22 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.582 0.23 . . . . 0.0 110.829 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.49 -14.16 5.07 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.879 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.42 126.2 44.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 110.979 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 432' ' ' ILE . . . . . 1.018 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.06 172.94 15.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.279 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 433' ' ' PHE . . . . . 0.602 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.51 -176.42 2.81 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.968 0.413 . . . . 0.0 111.994 -178.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 434' ' ' VAL . . . . . 0.616 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.76 141.76 41.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.165 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 435' ' ' GLU . . . . . 0.483 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.7 tt0 -84.35 108.48 17.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.811 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.74 168.37 12.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.239 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 437' ' ' THR . . . . . 0.703 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.5 p -94.96 -45.32 7.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.465 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.93 146.59 52.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.077 0.465 . . . . 0.0 111.165 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.17 -12.8 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.239 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -54.91 24.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.152 0.501 . . . . 0.0 110.083 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -75.1 -29.46 60.61 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.805 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -31.86 72.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.142 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -78.59 -47.94 16.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.703 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.7 -11.97 59.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.723 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -56.16 3.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.898 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 446' ' ' MET . . . . . 0.42 ' HB3' HD21 ' B' ' 378' ' ' LEU . 2.9 ptm -61.54 -29.71 70.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.285 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.23 -16.23 63.55 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.626 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.59 -8.63 22.57 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.443 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 449' ' ' LEU . . . . . 0.403 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.68 -19.78 19.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.806 0.336 . . . . 0.0 110.943 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 21.8 p -70.71 130.06 40.76 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.992 175.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.49 -8.9 74.59 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.578 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 452' ' ' ARG . . . . . 0.425 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.98 -152.2 0.05 Allowed 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 117.206 0.503 . . . . 0.0 110.531 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 453' ' ' LYS . . . . . 0.477 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.11 2.29 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.858 0.361 . . . . 0.0 111.326 -179.902 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.3 -36.34 75.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.551 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.25 -50.96 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.82 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -157.2 24.94 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.753 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 457' ' ' ARG . . . . . 0.442 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.47 133.04 16.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.309 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 458' ' ' VAL . . . . . 0.404 HG12 HE22 ' A' ' 57' ' ' GLN . 7.1 p -64.42 135.92 27.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 O-C-N 121.656 -0.652 . . . . 0.0 111.183 -177.311 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 459' ' ' VAL . . . . . 0.459 HG12 HG23 ' B' ' 461' ' ' THR . 45.1 t -91.1 121.55 41.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.167 -176.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 460' ' ' VAL . . . . . 0.466 HG21 ' CD1' ' A' ' 53' ' ' ILE . 4.7 m -94.35 98.09 7.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.507 0.67 . . . . 0.0 110.488 176.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 461' ' ' THR . . . . . 0.459 HG23 HG12 ' B' ' 459' ' ' VAL . 17.0 p -97.53 128.88 44.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.122 -177.191 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 462' ' ' LYS . . . . . 0.557 ' HG3' ' HB3' ' B' ' 379' ' ' CYS . 5.8 ptmt -130.14 -160.5 1.04 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.742 -178.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 463' ' ' TYR . . . . . 0.426 ' H ' ' HB2' ' B' ' 462' ' ' LYS . 1.2 m-85 -114.96 147.01 40.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.59 -175.453 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 464' ' ' CYS . . . . . 0.565 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.92 148.98 47.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.15 0.5 . . . . 0.0 111.33 -179.901 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 465' ' ' ASP . . . . . 0.463 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.39 129.42 66.33 Favored Pre-proline 0 CA--C 1.529 0.153 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.373 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 466' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.11 -33.23 73.19 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.704 2.269 . . . . 0.0 112.06 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.53 7.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.374 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.43 -33.77 68.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 469' ' ' TYR . . . . . 0.483 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.05 -51.21 70.61 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.221 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.31 -47.59 69.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.393 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 471' ' ' ARG . . . . . 0.45 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.65 -2.11 49.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.432 -179.915 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.01 20.86 8.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.924 0.393 . . . . 0.0 110.232 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 473' ' ' ASP . . . . . 0.45 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.88 -20.82 25.14 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.947 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 . . . . . 0 N--CA 1.471 0.601 0 CA-C-O 120.952 0.406 . . . . 0.0 111.078 -177.57 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.368 0.128 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.18 115.53 2.54 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.932 2.422 . . . . 0.0 112.32 177.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.02 -166.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.85 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.44 51.92 12.11 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.896 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.4 -36.21 3.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.927 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.72 91.85 2.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.96 -54.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.837 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.14 13.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.945 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.9 125.57 24.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.806 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 21' ' ' ARG . 0.9 OUTLIER -112.62 12.83 19.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.982 -179.763 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.549 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 72.0 m95 -142.02 53.1 1.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.756 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.28 -156.64 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.794 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.484 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.25 -37.73 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.852 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.71 120.58 40.56 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.534 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.6 p . . . . . 0 C--N 1.331 -0.239 0 O-C-N 124.007 0.817 . . . . 0.0 110.869 -178.718 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.482 ' HB3' ' HG3' ' A' ' 49' ' ' GLU . 3.6 mm? . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.93 0.395 . . . . 0.0 111.479 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.423 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 7.6 p -90.76 155.93 18.44 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.35 173.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.525 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -63.01 -31.29 72.4 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 120.933 0.397 . . . . 0.0 111.388 -174.253 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.423 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.35 -45.06 61.53 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.29 -33.49 73.27 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.763 -177.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.482 ' HG3' ' HB3' ' A' ' 44' ' ' LEU . 43.6 mt-10 -61.04 -44.54 97.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.21 177.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.558 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.77 -43.38 98.94 Favored 'General case' 0 C--O 1.185 -2.318 0 CA-C-O 118.884 -0.579 . . . . 0.0 110.234 177.037 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.551 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.41 -43.41 88.62 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 123.739 0.65 . . . . 0.0 111.535 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -65.4 -39.07 91.74 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.858 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.684 ' HA ' HD23 ' A' ' 56' ' ' LEU . 36.0 mm -78.64 -41.09 24.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.365 -178.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.1 m -65.57 -35.5 75.39 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.84 0 CA-C-O 118.664 -0.684 . . . . 0.0 111.898 176.416 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.05 -43.04 91.65 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.509 0.595 . . . . 0.0 110.353 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.684 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.3 OUTLIER -64.93 -38.62 91.56 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.646 177.55 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.51 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 9.3 mt-30 -75.14 -30.37 60.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.421 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.47 HD13 HD13 ' A' ' 113' ' ' ILE . 72.5 mt -65.8 -47.02 87.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 122.836 0.454 . . . . 0.0 110.341 175.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.42 -41.16 85.3 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.64 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -70.33 -31.37 68.64 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.225 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.537 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.64 -44.92 76.76 Favored 'General case' 0 C--O 1.207 -1.162 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 172.678 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.5 -35.81 82.0 Favored 'General case' 0 N--CA 1.432 -1.346 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -178.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.501 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.79 -42.76 76.05 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.197 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.537 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.79 -47.76 83.68 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 113.846 -1.524 . . . . 0.0 111.93 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.416 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.04 -29.0 63.73 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.867 176.959 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.96 -47.13 69.47 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.501 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.07 -17.69 14.41 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 119.974 -0.69 . . . . 0.0 112.815 -177.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.89 29.41 10.6 Favored Glycine 0 C--N 1.315 -0.621 0 C-N-CA 119.896 -1.145 . . . . 0.0 111.254 -177.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.4 92.95 7.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.214 0.531 . . . . 0.0 110.135 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.8 tp . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.536 177.216 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.436 -1.144 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.09 -52.53 16.36 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.218 -0.926 . . . . 0.0 109.667 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.462 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.6 mp0 -53.34 -51.74 61.46 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-N 113.614 -1.63 . . . . 0.0 110.66 -178.703 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -66.61 -38.75 87.63 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 113.456 -1.702 . . . . 0.0 110.653 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.533 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.87 -44.51 94.12 Favored 'General case' 0 CA--C 1.512 -0.495 0 O-C-N 123.265 0.353 . . . . 0.0 110.356 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.728 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.8 m -69.02 -50.05 52.26 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 120.069 -0.653 . . . . 0.0 110.637 179.057 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.45 -41.24 93.66 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -175.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.08 -39.1 89.78 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.19 -40.16 89.07 Favored 'General case' 0 C--O 1.223 -0.308 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.728 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.93 -41.09 97.73 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.648 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.0 -34.45 78.47 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.73 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.44 -34.29 74.21 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.55 -48.79 76.05 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.607 -1.256 . . . . 0.0 107.607 175.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.559 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.24 -45.54 94.11 Favored 'General case' 0 C--O 1.213 -0.819 0 CA-C-N 114.494 -1.23 . . . . 0.0 110.436 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.28 -37.42 85.46 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.565 0.746 . . . . 0.0 110.99 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.78 -43.74 85.78 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.7 mt -72.23 -38.63 68.92 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.769 177.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.559 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.39 -50.91 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 110.51 -0.181 . . . . 0.0 110.51 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.5 m -60.7 -39.46 88.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.195 0.521 . . . . 0.0 110.535 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.611 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.52 61.24 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.004 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.43 -37.09 84.41 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.8 t -65.54 -36.86 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 176.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.72 80.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.226 0.536 . . . . 0.0 110.23 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.7 mt -71.61 -40.5 69.77 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.984 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.58 111.19 12.53 Favored Pre-proline 0 C--N 1.315 -0.896 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.013 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.68 -22.81 36.99 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.837 2.358 . . . . 0.0 112.558 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.16 0.01 55.98 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.191 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.94 134.7 54.53 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.617 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.39 109.07 62.8 Favored Pre-proline 0 CA--C 1.51 -0.589 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.32 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.23 157.93 59.67 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 122.261 1.974 . . . . 0.0 111.501 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.64 154.5 25.23 Favored 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 123.626 2.884 . . . . 0.0 111.768 177.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.08 -31.37 70.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -91.77 34.96 0.97 Allowed 'General case' 0 C--O 1.233 0.22 0 O-C-N 123.474 0.484 . . . . 0.0 111.618 -177.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 41.4 t80 . . . . . 0 C--N 1.331 -0.227 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.215 176.574 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo . . . . . 0 N--CA 1.473 0.299 0 CA-C-O 120.753 0.231 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 375' ' ' THR . . . . . 0.468 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -143.35 -71.42 0.31 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.179 -177.557 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 376' ' ' GLU . . . . . 0.485 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.9 -45.91 0.01 OUTLIER 'General case' 0 C--O 1.231 0.108 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 377' ' ' VAL . . . . . 0.558 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.95 7.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.478 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 378' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.63 152.5 20.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.193 -178.989 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 379' ' ' CYS . . . . . 0.604 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.53 142.53 46.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.631 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.61 HD23 HG22 ' B' ' 461' ' ' THR . 5.3 mt -132.71 102.33 5.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.377 . . . . 0.0 111.01 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 21.6 ttt -117.15 164.89 14.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.26 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.2 t30 58.15 51.12 8.97 Favored 'General case' 0 C--O 1.232 0.154 0 O-C-N 123.338 0.399 . . . . 0.0 111.278 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 383' ' ' MET . . . . . 0.79 ' HB3' HG12 ' B' ' 459' ' ' VAL . 3.0 ptm -164.86 14.37 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.258 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 384' ' ' VAL . . . . . 0.733 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.27 125.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 0.0 111.372 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.83 151.7 43.08 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.4 179.464 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.07 -23.52 73.62 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.353 2.035 . . . . 0.0 112.36 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.89 -5.48 53.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.494 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.77 5.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.872 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 389' ' ' LEU . . . . . 0.473 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.97 0.46 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.969 0.414 . . . . 0.0 110.615 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.58 -15.72 5.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.652 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.36 148.76 23.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.542 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -73.57 -30.16 62.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.276 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.42 -47.66 26.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.713 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.6 -44.25 91.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.743 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.44 -59.32 5.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.221 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -27.38 61.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.27 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.08 -41.06 67.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.423 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 398' ' ' ILE . . . . . 0.493 HD13 HG12 ' B' ' 384' ' ' VAL . 65.5 mt -74.94 -53.64 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.516 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 399' ' ' VAL . . . . . 0.615 HG22 HD12 ' B' ' 417' ' ' ILE . 59.4 t -53.25 -46.98 57.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.807 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.42 -60.0 3.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.789 0.328 . . . . 0.0 111.523 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.52 -57.31 11.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.359 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.01 -32.96 15.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.326 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 403' ' ' ARG . . . . . 0.46 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.2 OUTLIER -71.18 -57.38 4.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.715 0.293 . . . . 0.0 111.149 -179.919 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.93 -33.69 64.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.15 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 405' ' ' GLU . . . . . 0.549 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.43 -47.02 45.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.809 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.96 -23.87 67.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.171 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.39 1.1 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.966 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.1 -17.17 12.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.877 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.61 -15.47 14.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.561 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.12 -139.41 4.15 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.536 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.29 132.46 56.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.714 0.292 . . . . 0.0 111.065 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 412' ' ' VAL . . . . . 0.433 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.39 115.46 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.991 0.424 . . . . 0.0 110.58 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 413' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.64 -61.93 2.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.226 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.04 -169.4 3.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.109 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 415' ' ' ILE . . . . . 0.617 HG23 HG12 ' B' ' 434' ' ' VAL . 48.8 mt -145.09 128.83 11.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 416' ' ' GLU . . . . . 0.436 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.78 108.83 18.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.732 179.781 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 417' ' ' ILE . . . . . 1.008 HG23 HG21 ' B' ' 432' ' ' ILE . 60.5 mt -128.53 108.47 19.04 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.708 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 418' ' ' PRO . . . . . 0.632 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.5 147.6 9.01 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.663 2.242 . . . . 0.0 112.904 -179.279 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.84 74.75 22.06 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.143 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.27 117.11 2.07 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.79 2.327 . . . . 0.0 112.402 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 421' ' ' VAL . . . . . 0.581 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.5 t -74.39 97.78 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.187 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.57 21.82 9.06 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.557 0.694 . . . . 0.0 109.314 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 423' ' ' GLY . . . . . 0.648 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.39 29.22 6.07 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.278 -179.07 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 424' ' ' VAL . . . . . 0.581 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.5 -37.6 30.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.103 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.84 35.97 4.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.804 0.335 . . . . 0.0 111.753 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 426' ' ' VAL . . . . . 0.667 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.39 -44.63 47.0 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.819 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 427' ' ' PRO . . . . . 0.667 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.33 77.07 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.473 2.115 . . . . 0.0 111.107 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.31 -15.38 3.21 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.313 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.2 t -67.52 149.39 50.23 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.511 0.196 . . . . 0.0 110.885 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.5 -14.27 5.06 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.912 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.37 126.17 44.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.845 0.355 . . . . 0.0 111.08 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 432' ' ' ILE . . . . . 1.008 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.08 172.93 15.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.281 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 433' ' ' PHE . . . . . 0.604 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.37 2.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.958 0.409 . . . . 0.0 111.962 -178.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 434' ' ' VAL . . . . . 0.617 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.82 141.72 41.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.176 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 435' ' ' GLU . . . . . 0.486 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.4 108.55 17.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.821 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.78 168.37 12.52 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.249 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 437' ' ' THR . . . . . 0.698 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -94.96 -45.43 7.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.404 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.85 146.69 52.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.128 0.489 . . . . 0.0 111.183 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.22 -12.84 16.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.192 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.8 26.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.123 0.487 . . . . 0.0 110.129 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.15 -29.44 60.48 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.889 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.14 -31.81 72.34 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.186 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -78.69 -48.03 15.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.646 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.07 59.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.709 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.83 -54.9 3.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.961 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 446' ' ' MET . . . . . 0.474 ' HB3' HD21 ' B' ' 378' ' ' LEU . 4.1 ptm -64.76 -27.57 68.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.957 -179.051 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.58 -16.2 63.36 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.64 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.66 -8.53 22.57 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.464 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 449' ' ' LEU . . . . . 0.408 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.3 mt -95.82 -19.77 19.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.712 0.291 . . . . 0.0 110.916 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 450' ' ' THR . . . . . 0.434 HG23 ' O ' ' B' ' 446' ' ' MET . 23.1 p -69.54 131.36 44.57 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.104 175.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.63 -9.59 76.66 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.677 -0.773 . . . . 0.0 113.377 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 452' ' ' ARG . . . . . 0.427 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -75.74 -152.2 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 117.2 0.5 . . . . 0.0 110.513 178.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 453' ' ' LYS . . . . . 0.484 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.87 117.15 2.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.948 0.404 . . . . 0.0 111.338 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.23 -36.4 75.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.542 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.21 -50.98 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.846 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.25 25.0 0.3 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.787 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 457' ' ' ARG . . . . . 0.434 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.47 136.22 19.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.325 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 7.2 p -58.38 132.23 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 121.124 0.488 . . . . 0.0 110.949 178.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 459' ' ' VAL . . . . . 0.79 HG12 ' HB3' ' B' ' 383' ' ' MET . 0.9 OUTLIER -90.99 122.12 42.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.819 -174.978 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 460' ' ' VAL . . . . . 0.445 HG21 HG13 ' A' ' 53' ' ' ILE . 59.6 t -88.89 98.21 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.319 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 461' ' ' THR . . . . . 0.61 HG22 HD23 ' B' ' 380' ' ' LEU . 1.4 p -98.12 129.64 44.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.842 177.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 462' ' ' LYS . . . . . 0.467 ' HE3' ' HB2' ' B' ' 462' ' ' LYS . 0.5 OUTLIER -130.58 -166.35 1.67 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.268 0.556 . . . . 0.0 111.148 -179.045 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.59 146.93 37.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.525 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 464' ' ' CYS . . . . . 0.558 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.81 148.98 47.48 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.065 0.46 . . . . 0.0 111.378 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 465' ' ' ASP . . . . . 0.468 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.46 129.35 66.42 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.398 -179.881 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 466' ' ' PRO . . . . . 0.485 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.06 -33.21 72.62 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.685 2.257 . . . . 0.0 112.103 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.07 -58.48 7.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.38 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.5 -33.67 68.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.25 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 469' ' ' TYR . . . . . 0.486 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.1 -51.18 70.7 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.183 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.37 -47.53 69.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.37 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 471' ' ' ARG . . . . . 0.451 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.73 -2.09 49.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.45 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.09 20.8 8.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.975 0.417 . . . . 0.0 110.275 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 473' ' ' ASP . . . . . 0.451 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.85 -21.48 29.49 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.954 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 . . . . . 0 N--CA 1.472 0.646 0 C-N-CA 123.121 0.568 . . . . 0.0 111.264 -177.388 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 31.3 p90 . . . . . 0 C--O 1.233 0.189 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 38.8 Cg_exo -56.52 115.56 2.57 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 123.265 2.643 . . . . 0.0 112.323 -174.279 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.92 12.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.94 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.36 -36.27 3.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.995 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.8 2.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.856 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.84 -54.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.812 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.9 111.13 13.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.94 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.92 125.59 24.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.697 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.62 12.88 19.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.992 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.553 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.8 m95 -142.06 53.02 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.706 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.29 -156.54 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.84 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.471 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.33 -37.63 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.867 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.75 121.29 42.86 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.557 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 p . . . . . 0 C--N 1.327 -0.388 0 O-C-N 123.625 0.578 . . . . 0.0 111.067 179.207 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 44' ' ' LEU . 3.4 mm? . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.927 0.394 . . . . 0.0 111.521 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.459 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 1.4 p -84.93 154.27 22.31 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.605 175.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.522 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.06 -31.3 71.71 Favored 'General case' 0 C--O 1.24 0.597 0 O-C-N 123.368 0.418 . . . . 0.0 111.395 -175.029 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.459 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.3 -45.23 60.91 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.18 -32.69 72.17 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.753 -177.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.454 ' O ' HG12 ' A' ' 53' ' ' ILE . 36.1 mt-10 -61.16 -44.78 96.78 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.243 178.01 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.561 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.37 -43.32 97.94 Favored 'General case' 0 C--O 1.186 -2.252 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.235 177.256 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.552 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.43 -42.13 86.61 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 123.719 0.637 . . . . 0.0 111.585 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -66.29 -38.86 88.76 Favored 'General case' 0 N--CA 1.462 0.165 0 O-C-N 123.824 0.703 . . . . 0.0 110.933 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.598 ' HA ' HD23 ' A' ' 56' ' ' LEU . 29.6 mm -78.31 -41.52 26.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.197 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.561 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -66.41 -35.44 74.92 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.809 0 CA-C-O 118.586 -0.721 . . . . 0.0 111.958 177.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.15 -45.43 90.99 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 118.541 0.61 . . . . 0.0 110.308 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.598 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.1 OUTLIER -70.55 -23.71 62.67 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.077 -178.321 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -89.53 -26.67 20.75 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.669 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.487 HD13 HD13 ' A' ' 113' ' ' ILE . 72.7 mt -64.04 -46.94 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.175 0.59 . . . . 0.0 110.395 170.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.433 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.45 -41.15 85.17 Favored 'General case' 0 CA--C 1.513 -0.474 0 C-N-CA 120.294 -0.563 . . . . 0.0 110.685 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -36.5 83.11 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.844 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.529 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -66.61 -44.95 80.71 Favored 'General case' 0 C--O 1.206 -1.187 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.51 -35.81 81.98 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.82 -42.76 76.19 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 122.095 0.95 . . . . 0.0 108.53 176.249 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.529 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.76 -47.73 83.88 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 113.827 -1.533 . . . . 0.0 111.897 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.423 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.23 -28.79 63.39 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 119.741 -0.784 . . . . 0.0 111.831 176.99 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -68.1 -47.07 69.19 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.48 14.46 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 119.965 -0.694 . . . . 0.0 112.86 -177.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.77 29.41 10.74 Favored Glycine 0 C--N 1.316 -0.565 0 C-N-CA 119.804 -1.188 . . . . 0.0 111.28 -177.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.4 91.08 6.77 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.253 0.549 . . . . 0.0 110.215 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.454 178.355 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.435 -1.206 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.11 -52.5 16.46 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.261 -0.9 . . . . 0.0 109.706 -178.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.458 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.3 mp0 -53.34 -51.7 61.58 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-N 113.663 -1.608 . . . . 0.0 110.656 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.64 -38.75 87.55 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.435 -1.712 . . . . 0.0 110.704 -177.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.53 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.83 -44.59 93.98 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 123.237 0.336 . . . . 0.0 110.371 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.722 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.7 m -69.05 -50.0 52.49 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.613 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.46 -41.27 93.55 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -175.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.0 -39.17 90.05 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 110.351 -0.241 . . . . 0.0 110.351 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 100' ' ' ARG . 6.2 tmtt? -60.23 -40.13 89.12 Favored 'General case' 0 C--O 1.223 -0.308 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.93 -41.06 97.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.135 -0.938 . . . . 0.0 110.663 178.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.01 -34.36 78.26 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.811 178.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.52 -34.29 74.05 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 177.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.45 -48.86 75.99 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 175.425 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.559 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.2 ttp180 -61.26 -45.51 94.21 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.441 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.21 -37.47 85.47 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 123.567 0.747 . . . . 0.0 111.016 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.79 -43.73 85.8 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.8 mt -72.3 -38.49 68.73 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.814 177.379 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.559 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.4 -50.98 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 110.472 -0.195 . . . . 0.0 110.472 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.9 m -60.6 -39.6 88.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.219 0.533 . . . . 0.0 110.514 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.608 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.89 -49.64 60.83 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.952 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.1 84.46 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.3 t -65.52 -36.87 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 176.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.7 79.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.197 0.523 . . . . 0.0 110.22 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.3 mt -71.46 -40.56 70.23 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.045 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.63 111.22 12.48 Favored Pre-proline 0 C--N 1.316 -0.853 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.76 -22.63 36.8 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.861 2.374 . . . . 0.0 112.588 -178.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.34 0.07 55.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.405 0.621 . . . . 0.0 111.178 -177.063 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.84 134.61 54.43 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.61 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.35 109.16 62.89 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.323 177.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.27 157.92 59.76 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.271 1.981 . . . . 0.0 111.501 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.56 154.5 24.82 Favored 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 123.648 2.899 . . . . 0.0 111.813 177.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.1 -31.49 71.13 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -90.08 20.73 4.1 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 123.771 0.669 . . . . 0.0 111.733 -176.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 23.2 t80 . . . . . 0 C--N 1.331 -0.224 0 CA-C-O 120.815 0.34 . . . . 0.0 110.151 175.583 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 CA--C 1.529 0.262 0 CA-C-O 121.114 0.381 . . . . 0.0 112.973 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 375' ' ' THR . . . . . 0.454 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -120.84 -71.3 0.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.166 178.638 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 376' ' ' GLU . . . . . 0.492 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.96 0.01 OUTLIER 'General case' 0 C--O 1.231 0.097 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 377' ' ' VAL . . . . . 0.554 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.95 7.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.471 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 378' ' ' LEU . . . . . 0.49 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.55 152.54 20.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.271 -179.072 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 379' ' ' CYS . . . . . 0.611 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.57 142.53 46.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.59 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.51 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.73 101.82 5.43 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.925 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 381' ' ' MET . . . . . 0.403 ' HG2' ' N ' ' B' ' 382' ' ' ASN . 20.3 ttt -116.83 164.7 14.27 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.59 -178.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 382' ' ' ASN . . . . . 0.403 ' N ' ' HG2' ' B' ' 381' ' ' MET . 13.1 t30 58.58 51.19 8.14 Favored 'General case' 0 C--N 1.342 0.278 0 O-C-N 123.479 0.487 . . . . 0.0 111.316 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 383' ' ' MET . . . . . 0.433 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.85 14.4 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.253 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 384' ' ' VAL . . . . . 0.737 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.31 125.17 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.845 0.355 . . . . 0.0 111.311 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.412 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.0 mt -110.78 151.78 43.1 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.34 179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.25 -23.35 72.5 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.273 1.982 . . . . 0.0 112.343 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.94 -5.52 53.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.484 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.02 -36.76 5.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.904 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 389' ' ' LEU . . . . . 0.477 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.96 34.92 0.46 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.913 0.387 . . . . 0.0 110.636 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.55 -15.66 5.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.659 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.31 148.71 23.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.573 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -73.5 -30.25 63.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.225 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.35 -47.68 26.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.754 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.51 -44.26 91.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.852 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.41 -59.45 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.162 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -27.29 61.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.275 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.23 -40.94 67.39 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.429 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 398' ' ' ILE . . . . . 0.496 HD13 HG12 ' B' ' 384' ' ' VAL . 65.5 mt -74.93 -53.65 16.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.525 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 399' ' ' VAL . . . . . 0.617 HG22 HD12 ' B' ' 417' ' ' ILE . 59.7 t -53.3 -46.86 57.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.846 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.47 -60.0 3.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.74 0.305 . . . . 0.0 111.526 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.69 -57.14 11.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.341 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.7 t -52.04 -32.99 15.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.387 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 403' ' ' ARG . . . . . 0.46 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.15 -57.39 4.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 111.173 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.9 -33.62 64.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.214 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 405' ' ' GLU . . . . . 0.553 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 22.0 mm-40 -73.48 -47.06 44.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.963 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.81 -23.97 67.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.131 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.08 30.25 1.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.895 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.01 -17.18 12.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.42 14.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.551 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.14 -139.46 4.17 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.553 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.21 132.51 56.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.09 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 412' ' ' VAL . . . . . 0.422 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.38 115.45 48.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.028 0.442 . . . . 0.0 110.658 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 413' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.69 -61.97 2.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.179 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.96 -169.33 3.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.188 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 415' ' ' ILE . . . . . 0.613 HG23 HG12 ' B' ' 434' ' ' VAL . 48.6 mt -145.2 128.94 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.825 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 416' ' ' GLU . . . . . 0.429 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.93 108.76 18.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.692 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 417' ' ' ILE . . . . . 0.969 HG23 HG21 ' B' ' 432' ' ' ILE . 60.1 mt -128.42 108.48 19.24 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.688 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 418' ' ' PRO . . . . . 0.637 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.48 147.61 8.95 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.673 2.248 . . . . 0.0 112.913 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.86 74.61 22.1 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.155 179.899 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.1 117.0 1.96 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.782 2.321 . . . . 0.0 112.46 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 421' ' ' VAL . . . . . 0.599 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.2 t -74.34 97.84 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.199 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.5 21.84 8.99 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.61 0.719 . . . . 0.0 109.386 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 423' ' ' GLY . . . . . 0.634 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.31 29.21 6.1 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.273 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 424' ' ' VAL . . . . . 0.599 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.42 -37.57 31.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.86 35.92 4.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.331 . . . . 0.0 111.825 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 426' ' ' VAL . . . . . 0.677 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.41 -44.59 46.65 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.827 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 427' ' ' PRO . . . . . 0.677 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.8 Cg_endo -66.3 77.07 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.516 2.144 . . . . 0.0 111.113 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.34 -15.47 3.2 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.338 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.53 149.37 50.25 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.591 0.234 . . . . 0.0 110.793 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.54 -14.24 5.05 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.856 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 126.16 44.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.833 0.349 . . . . 0.0 111.028 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 432' ' ' ILE . . . . . 0.969 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -131.03 172.89 15.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.243 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 433' ' ' PHE . . . . . 0.611 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.3 2.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.989 0.423 . . . . 0.0 111.974 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 434' ' ' VAL . . . . . 0.613 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.88 141.71 41.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.207 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 435' ' ' GLU . . . . . 0.484 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.3 108.49 17.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.819 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.79 168.36 12.53 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.227 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 437' ' ' THR . . . . . 0.698 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.93 -45.39 7.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.438 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.91 146.66 52.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.096 0.474 . . . . 0.0 111.215 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.25 -12.7 16.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.263 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.87 25.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.082 0.468 . . . . 0.0 110.088 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.16 -29.37 60.43 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.864 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.32 -31.68 72.32 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.168 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -78.64 -48.06 15.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.649 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.08 59.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.719 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -55.6 3.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.993 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 446' ' ' MET . . . . . 0.49 ' HB3' HD21 ' B' ' 378' ' ' LEU . 3.4 ptm -64.14 -26.98 68.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.178 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.16 -16.25 63.06 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.625 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.51 22.7 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.415 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 449' ' ' LEU . . . . . 0.66 ' HB2' HG21 ' B' ' 461' ' ' THR . 97.2 mt -95.72 -20.55 18.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.797 0.332 . . . . 0.0 110.894 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 3.3 t -72.59 131.72 42.83 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.899 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.98 -9.81 72.53 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.157 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 452' ' ' ARG . . . . . 0.417 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.3 mmm180 -77.11 -152.22 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 117.239 0.52 . . . . 0.0 110.587 178.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 453' ' ' LYS . . . . . 0.471 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.83 117.08 2.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.853 0.358 . . . . 0.0 111.285 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.23 -36.43 75.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.524 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.16 -50.92 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.814 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.23 24.86 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.761 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 457' ' ' ARG . . . . . 0.433 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.38 134.77 18.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.344 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 2.8 m -59.65 138.42 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-O 121.042 0.449 . . . . 0.0 111.62 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 57.5 t -98.73 115.79 40.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.419 -176.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 460' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -82.81 114.5 23.75 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.796 174.385 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 461' ' ' THR . . . . . 0.66 HG21 ' HB2' ' B' ' 449' ' ' LEU . 14.1 p -100.96 132.14 46.51 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.139 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 462' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.46 -175.74 3.54 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.727 0.775 . . . . 0.0 111.455 -177.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -111.54 146.9 36.5 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.473 172.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 464' ' ' CYS . . . . . 0.554 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 149.03 47.47 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.992 0.425 . . . . 0.0 111.431 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 465' ' ' ASP . . . . . 0.454 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.46 129.36 66.37 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.374 -179.812 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 466' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -53.98 -33.31 72.16 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.76 2.307 . . . . 0.0 112.127 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -58.49 7.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.399 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.44 -33.72 68.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.278 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 469' ' ' TYR . . . . . 0.484 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.03 -51.23 70.54 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.203 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.36 -47.6 69.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.291 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 471' ' ' ARG . . . . . 0.453 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.67 -2.19 49.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.383 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.78 8.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 0.0 110.234 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 473' ' ' ASP . . . . . 0.453 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.66 -20.45 21.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.951 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 11.5 p90 . . . . . 0 N--CA 1.477 0.884 0 C-N-CA 124.82 1.248 . . . . 0.0 112.771 -177.428 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 . . . . . 0 C--O 1.233 0.192 0 CA-C-O 120.455 0.169 . . . . 0.0 110.948 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.28 115.57 2.57 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.936 2.424 . . . . 0.0 112.25 172.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.02 -166.75 1.32 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.859 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.91 12.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.878 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.3 -36.29 3.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.043 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.76 91.89 2.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.855 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.9 -54.33 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.786 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.82 111.24 13.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.01 125.63 25.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.787 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.59 12.78 19.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.976 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.552 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.4 m95 -141.97 53.08 1.48 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.791 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -156.58 0.13 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.854 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.475 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.33 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.927 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.73 120.36 39.81 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.609 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.9 m . . . . . 0 C--N 1.331 -0.211 0 O-C-N 123.655 0.597 . . . . 0.0 110.782 -177.578 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.497 ' CD2' ' HB2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.22 0 CA-C-O 120.942 0.401 . . . . 0.0 111.665 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.52 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 23.3 p -106.08 163.43 12.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.178 178.403 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.512 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -60.98 -31.39 70.98 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.337 -176.504 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.52 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.32 -45.17 61.13 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.334 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.11 -33.44 73.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.762 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.497 ' HB2' ' CD2' ' A' ' 44' ' ' LEU . 41.6 tt0 -58.89 -46.49 87.73 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.344 177.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.553 ' O ' HG22 ' A' ' 54' ' ' VAL . 16.0 mmt180 -63.21 -43.36 98.34 Favored 'General case' 0 C--O 1.185 -2.304 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.267 177.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.539 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.45 -42.15 86.74 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 123.739 0.649 . . . . 0.0 111.58 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -64.31 -44.98 89.91 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.162 176.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.452 HD13 ' HA ' ' A' ' 53' ' ' ILE . 8.6 mm -71.5 -41.73 72.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.319 -179.273 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.553 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -67.21 -35.64 74.66 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.768 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.835 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.01 -43.32 91.52 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 118.558 0.617 . . . . 0.0 110.277 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.609 ' HG ' ' N ' ' A' ' 57' ' ' GLN . 0.1 OUTLIER -63.23 -41.91 99.16 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.776 176.817 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.609 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 14.4 mt-30 -72.51 -31.27 65.2 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.742 178.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.474 HD13 HD13 ' A' ' 113' ' ' ILE . 73.3 mt -64.51 -47.0 91.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 123.147 0.279 . . . . 0.0 110.447 176.38 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.46 -41.39 84.76 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.231 -0.588 . . . . 0.0 110.701 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.459 ' OD2' HD12 ' A' ' 56' ' ' LEU . 69.3 m-20 -69.1 -33.61 73.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.176 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.541 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -65.92 -45.0 83.52 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 173.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 m -65.51 -35.73 81.73 Favored 'General case' 0 N--CA 1.433 -1.321 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.496 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.84 -42.75 76.23 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 122.055 0.931 . . . . 0.0 108.505 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.541 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.85 -47.72 83.75 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 113.837 -1.528 . . . . 0.0 111.871 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.412 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.23 -28.84 63.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.818 177.028 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -67.95 -47.17 69.39 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.496 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.48 14.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.916 -0.714 . . . . 0.0 112.858 -177.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.78 29.41 10.73 Favored Glycine 0 C--N 1.316 -0.575 0 C-N-CA 119.809 -1.186 . . . . 0.0 111.267 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.43 92.11 6.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.227 0.537 . . . . 0.0 110.138 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.2 tp . . . . . 0 N--CA 1.463 0.201 0 CA-C-O 120.817 0.341 . . . . 0.0 111.024 179.954 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.435 -1.179 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.23 -52.44 16.41 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.191 -0.943 . . . . 0.0 109.603 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.456 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.4 mp0 -53.33 -51.75 61.37 Favored 'General case' 0 CA--C 1.503 -0.836 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.629 -178.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.62 -38.71 87.5 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 113.417 -1.719 . . . . 0.0 110.686 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.526 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.99 -44.45 94.5 Favored 'General case' 0 CA--C 1.511 -0.528 0 O-C-N 123.209 0.318 . . . . 0.0 110.363 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.717 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.4 m -68.99 -50.08 52.11 Favored 'General case' 0 N--CA 1.428 -1.54 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.629 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.44 -41.32 93.61 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -175.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.02 -39.1 89.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.547 0.213 . . . . 0.0 110.432 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.532 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.22 -40.15 89.13 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.717 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.7 mt -63.99 -41.02 97.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.641 178.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.06 -34.39 78.3 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.798 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.4 -34.36 74.37 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 177.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.46 -48.76 76.36 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 175.502 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.54 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.37 -45.41 94.49 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.405 179.063 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.28 -37.47 85.65 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.939 -178.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.76 -43.81 85.7 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.5 mt -72.17 -38.58 69.1 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.749 177.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.54 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.0 mm -57.49 -50.79 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 110.507 -0.182 . . . . 0.0 110.507 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.9 m -60.84 -39.37 88.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.212 0.529 . . . . 0.0 110.523 -179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.609 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -68.0 -49.59 60.66 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.02 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.3 -37.21 84.88 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.5 t -65.41 -36.9 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-O 121.171 0.51 . . . . 0.0 109.657 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.69 -40.69 79.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.2 0.524 . . . . 0.0 110.238 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.0 mt -71.41 -40.56 70.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.118 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.66 111.14 12.43 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.957 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.73 -22.64 36.97 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.78 2.32 . . . . 0.0 112.545 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.38 0.23 55.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.337 0.589 . . . . 0.0 111.151 -177.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -65.02 134.63 54.29 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.623 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.34 109.17 62.91 Favored Pre-proline 0 CA--C 1.509 -0.622 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.276 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -68.31 157.97 59.53 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.317 2.011 . . . . 0.0 111.456 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.69 154.44 25.73 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 123.634 2.889 . . . . 0.0 111.711 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.95 -30.41 69.7 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -173.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -85.54 3.49 40.31 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 123.716 0.635 . . . . 0.0 111.481 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 33.2 t80 . . . . . 0 C--N 1.333 -0.128 0 CA-C-O 120.875 0.369 . . . . 0.0 110.644 178.686 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.635 0.181 . . . . 0.0 111.699 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 375' ' ' THR . . . . . 0.46 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -126.29 -71.35 0.69 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.165 -174.72 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 376' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.9 0.01 OUTLIER 'General case' 0 C--O 1.231 0.095 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 377' ' ' VAL . . . . . 0.561 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.7 150.89 8.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.458 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 378' ' ' LEU . . . . . 0.626 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.57 152.53 20.86 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.276 -179.078 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 379' ' ' CYS . . . . . 0.609 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.49 142.53 46.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.684 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.508 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.71 101.84 5.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.953 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 2.6 tmm? -117.86 166.49 12.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.45 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.2 t30 57.8 51.18 9.52 Favored 'General case' 0 CA--C 1.528 0.105 0 O-C-N 123.599 0.562 . . . . 0.0 111.415 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 383' ' ' MET . . . . . 0.812 ' HB3' HG12 ' B' ' 459' ' ' VAL . 3.0 ptm -164.85 14.33 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.236 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 384' ' ' VAL . . . . . 0.743 HG21 HG23 ' B' ' 432' ' ' ILE . 0.4 OUTLIER -152.27 125.17 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.86 0.362 . . . . 0.0 111.308 179.876 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.72 151.76 43.05 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.396 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.16 -23.47 73.05 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.286 1.991 . . . . 0.0 112.294 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.91 -5.52 53.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.45 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.69 5.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.928 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 389' ' ' LEU . . . . . 0.477 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.595 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 390' ' ' LEU . . . . . 0.557 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.62 -15.69 5.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.605 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.3 148.83 23.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.606 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -73.64 -30.23 62.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.16 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.33 -47.61 26.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.997 0.427 . . . . 0.0 110.833 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.59 -44.23 91.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.841 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.37 -59.43 4.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.181 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -27.25 61.5 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.196 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.2 -41.05 67.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.401 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 398' ' ' ILE . . . . . 0.496 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.83 -53.65 16.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.542 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 399' ' ' VAL . . . . . 0.62 HG22 HD12 ' B' ' 417' ' ' ILE . 59.7 t -53.32 -46.91 58.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.817 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.5 -59.94 3.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.526 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.67 -57.14 11.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.369 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.13 -32.88 15.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.303 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 403' ' ' ARG . . . . . 0.46 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.19 -57.36 4.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.751 0.31 . . . . 0.0 111.166 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.92 -33.66 64.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.171 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 405' ' ' GLU . . . . . 0.552 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.43 -47.1 44.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.83 -23.96 67.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.13 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.14 30.28 1.12 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.932 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.08 -17.06 12.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.74 -15.45 14.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.558 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.19 -139.45 4.15 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.573 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.24 132.46 56.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.697 0.284 . . . . 0.0 111.113 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 412' ' ' VAL . . . . . 0.424 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.39 115.48 48.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.012 0.434 . . . . 0.0 110.543 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 413' ' ' LYS . . . . . 0.703 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.6 -61.96 2.06 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.248 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.04 -169.43 3.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.103 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 415' ' ' ILE . . . . . 0.616 HG23 HG12 ' B' ' 434' ' ' VAL . 48.3 mt -145.05 128.96 12.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.849 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 416' ' ' GLU . . . . . 0.422 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.91 108.84 18.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.702 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 417' ' ' ILE . . . . . 1.0 HG23 HG21 ' B' ' 432' ' ' ILE . 60.7 mt -128.52 108.62 19.07 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.637 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 418' ' ' PRO . . . . . 0.629 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.49 147.56 9.0 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.709 2.273 . . . . 0.0 112.87 -179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 419' ' ' ARG . . . . . 0.557 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.89 74.64 21.97 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.194 179.875 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -47.14 117.04 1.99 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.739 2.293 . . . . 0.0 112.504 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 421' ' ' VAL . . . . . 0.598 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.7 t -74.28 97.8 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.22 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.57 21.74 8.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.482 0.658 . . . . 0.0 109.348 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 423' ' ' GLY . . . . . 0.645 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.4 29.21 6.07 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.263 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 424' ' ' VAL . . . . . 0.598 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.45 -37.59 30.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.119 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.83 35.9 4.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.844 0.355 . . . . 0.0 111.849 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 426' ' ' VAL . . . . . 0.675 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.22 -44.75 49.35 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.839 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 427' ' ' PRO . . . . . 0.675 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.1 Cg_endo -66.33 77.16 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.537 2.158 . . . . 0.0 111.018 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.21 -15.43 3.23 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.367 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.5 149.37 50.26 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.615 0.245 . . . . 0.0 110.79 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.15 5.06 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.838 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.52 126.1 44.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.899 0.38 . . . . 0.0 111.0 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 432' ' ' ILE . . . . . 1.0 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -130.98 172.92 15.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.256 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 433' ' ' PHE . . . . . 0.609 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.34 2.79 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.954 -178.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 434' ' ' VAL . . . . . 0.616 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.85 141.73 41.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.188 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 435' ' ' GLU . . . . . 0.485 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.41 108.53 17.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.752 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.83 168.39 12.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.256 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 437' ' ' THR . . . . . 0.703 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -94.97 -45.4 7.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.451 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.87 146.67 52.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.07 0.462 . . . . 0.0 111.26 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.21 -12.77 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.165 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.62 -54.8 26.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.09 0.471 . . . . 0.0 110.096 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.14 -29.52 60.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.818 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.22 -31.68 72.26 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.22 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -78.66 -48.0 15.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.682 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.62 -12.03 59.52 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.738 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -55.28 3.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.949 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 446' ' ' MET . . . . . 0.626 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.2 OUTLIER -64.83 -26.6 68.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.199 -179.313 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.16 -16.2 63.06 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.588 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.62 -8.63 22.52 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.354 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 449' ' ' LEU . . . . . 0.403 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.3 mt -95.69 -20.76 18.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.726 0.298 . . . . 0.0 110.898 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 15.8 p -73.95 126.73 31.1 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.063 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 98.35 -9.06 62.77 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.978 178.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 452' ' ' ARG . . . . . 0.419 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -76.59 -152.21 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.787 0.293 . . . . 0.0 110.505 177.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 453' ' ' LYS . . . . . 0.475 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.1 2.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.768 0.318 . . . . 0.0 111.296 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.35 -36.29 75.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.515 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.26 -50.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.3 24.86 0.3 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.779 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 457' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.52 135.74 19.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.316 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 13.4 p -59.41 126.94 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 121.273 0.559 . . . . 0.0 111.034 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 459' ' ' VAL . . . . . 0.812 HG12 ' HB3' ' B' ' 383' ' ' MET . 3.7 m -84.86 127.82 39.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.844 -176.022 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 460' ' ' VAL . . . . . . . . . . . . . 47.0 t -95.45 92.55 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.063 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 67.5 p -100.25 128.01 46.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.907 0.384 . . . . 0.0 111.316 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 462' ' ' LYS . . . . . . . . . . . . . 11.7 mtmt -132.02 -159.67 0.98 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.038 -178.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -113.32 147.02 38.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.53 -179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 464' ' ' CYS . . . . . 0.561 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.88 149.0 47.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.049 0.452 . . . . 0.0 111.311 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 465' ' ' ASP . . . . . 0.46 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.33 129.34 66.86 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.405 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 466' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.09 -33.21 72.88 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.708 2.272 . . . . 0.0 112.095 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.06 -58.55 7.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.37 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.33 -33.81 68.11 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.291 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 469' ' ' TYR . . . . . 0.485 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.5 t80 -60.12 -51.18 70.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.162 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.42 -47.5 69.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.326 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 471' ' ' ARG . . . . . 0.455 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.17 49.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.39 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.11 20.8 8.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.888 0.375 . . . . 0.0 110.215 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 473' ' ' ASP . . . . . 0.455 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.72 -20.94 24.56 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.978 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 16.6 t80 . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 121.23 0.538 . . . . 0.0 110.541 178.289 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.1 p90 . . . . . 0 CA--C 1.531 0.235 0 N-CA-C 110.545 -0.169 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.77 115.49 2.52 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.664 2.243 . . . . 0.0 112.384 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.98 -166.76 1.33 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.904 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.34 51.97 12.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.41 -36.15 3.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.002 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.79 91.85 2.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.863 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.93 -54.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.799 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.87 111.13 13.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.005 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.93 125.69 25.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.735 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.67 12.73 19.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.961 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.612 ' HZ3' HG11 ' B' ' 459' ' ' VAL . 71.6 m95 -141.97 52.97 1.48 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.766 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.15 -156.59 0.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.928 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.478 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.3 -37.65 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.76 121.26 42.76 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 118.951 -0.547 . . . . 0.0 110.64 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.3 p . . . . . 0 C--N 1.325 -0.461 0 O-C-N 123.266 0.353 . . . . 0.0 110.904 -179.622 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.429 ' HG ' ' N ' ' A' ' 45' ' ' THR . 1.5 pt? . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 120.72 0.295 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.596 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 40.3 p -119.35 170.04 9.47 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.493 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.526 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.0 -31.32 71.68 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.297 178.74 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.596 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.32 -44.99 61.89 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.43 -33.27 72.72 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.631 -176.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -57.8 -48.23 80.3 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.095 176.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.554 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.62 -43.41 98.88 Favored 'General case' 0 C--O 1.186 -2.285 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.236 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.546 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.44 -40.08 81.57 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.782 0.676 . . . . 0.0 111.557 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -67.57 -45.79 74.55 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.021 175.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.606 HG23 HG21 ' B' ' 460' ' ' VAL . 95.8 mt -61.68 -49.14 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 177.203 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 50' ' ' ARG . 34.9 m -67.51 -35.54 73.55 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.776 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.916 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.15 -44.58 92.09 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.568 0.622 . . . . 0.0 110.319 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.5 tp -65.29 -35.36 80.77 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.976 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -75.12 -34.6 61.71 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.656 176.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.463 HD13 HD13 ' A' ' 113' ' ' ILE . 72.8 mt -63.05 -46.91 94.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.401 0.68 . . . . 0.0 110.433 177.258 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.41 -41.39 84.94 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.668 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -67.68 -34.01 76.06 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.404 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.529 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.48 -45.02 77.12 Favored 'General case' 0 C--O 1.207 -1.181 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 174.074 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.1 m -65.43 -35.86 82.2 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.498 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.8 -42.73 76.04 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.054 0.931 . . . . 0.0 108.529 176.208 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.529 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.84 -47.77 83.59 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 113.833 -1.53 . . . . 0.0 111.871 179.299 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.17 -28.92 63.54 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.758 177.093 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.91 -47.16 69.53 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.498 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.09 -17.52 14.46 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.75 29.47 10.68 Favored Glycine 0 C--N 1.315 -0.605 0 C-N-CA 119.858 -1.163 . . . . 0.0 111.259 -177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.4 92.07 6.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.185 0.517 . . . . 0.0 110.165 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 18.3 tp . . . . . 0 C--N 1.325 -0.464 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.503 179.141 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.2 t . . . . . 0 N--CA 1.436 -1.138 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.19 -52.43 16.55 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.329 -0.857 . . . . 0.0 109.693 -178.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.464 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.5 mp0 -53.27 -51.83 60.98 Favored 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 113.655 -1.611 . . . . 0.0 110.633 -178.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -66.67 -38.64 87.24 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.686 -177.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.96 -44.46 94.42 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 123.197 0.311 . . . . 0.0 110.385 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.711 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.9 m -69.06 -50.04 51.98 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.617 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.4 -41.28 93.82 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.95 -39.23 90.27 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 178.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.535 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.27 -40.06 89.04 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.711 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.4 mt -64.07 -40.94 97.37 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.648 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.12 -34.3 78.08 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.75 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.5 -34.39 74.23 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.4 -48.81 76.29 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.561 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.3 -45.55 94.01 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.39 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.14 -37.47 85.31 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 123.594 0.758 . . . . 0.0 111.004 -178.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.85 -43.76 86.13 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.4 mt -72.23 -38.57 68.92 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.773 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.561 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.38 -50.9 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 N-CA-C 110.514 -0.18 . . . . 0.0 110.514 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.7 m -60.71 -39.46 88.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.276 0.56 . . . . 0.0 110.551 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -68.0 -49.51 61.16 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.97 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.11 84.49 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -177.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.63 -36.85 78.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.53 -40.72 80.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.257 0.551 . . . . 0.0 110.299 177.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.5 mt -71.52 -40.6 70.0 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.982 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.64 111.23 12.47 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 116.3 -0.409 . . . . 0.0 109.929 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.78 -22.61 36.66 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.779 2.319 . . . . 0.0 112.62 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.29 0.06 55.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.409 0.623 . . . . 0.0 111.179 -177.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.91 134.64 54.42 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.606 -178.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.39 109.13 62.86 Favored Pre-proline 0 CA--C 1.509 -0.619 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.278 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.31 157.95 59.65 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.306 2.004 . . . . 0.0 111.507 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.67 154.52 25.35 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 123.589 2.859 . . . . 0.0 111.724 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.11 70.57 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -173.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -86.15 32.89 0.61 Allowed 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.765 0.666 . . . . 0.0 111.626 -177.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 9.3 p90 . . . . . 0 C--O 1.233 0.191 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.591 177.89 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 C--O 1.233 0.254 0 CA-C-O 120.964 0.319 . . . . 0.0 112.696 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 375' ' ' THR . . . . . 0.463 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -129.5 -71.32 0.62 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.217 179.161 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 376' ' ' GLU . . . . . 0.495 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.93 0.01 OUTLIER 'General case' 0 C--O 1.232 0.133 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 377' ' ' VAL . . . . . 0.56 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.62 150.99 7.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.402 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 378' ' ' LEU . . . . . 0.506 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.67 152.51 20.82 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.17 -179.085 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 379' ' ' CYS . . . . . 0.584 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.53 142.53 46.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.662 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.513 HD11 HG13 ' B' ' 434' ' ' VAL . 5.4 mt -132.71 101.9 5.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.96 -179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 91.4 mtp -117.36 166.89 11.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.849 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 57.46 51.2 10.08 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 123.649 0.593 . . . . 0.0 111.273 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 383' ' ' MET . . . . . 0.438 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.83 14.4 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.228 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 384' ' ' VAL . . . . . 0.697 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.25 125.06 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.721 0.296 . . . . 0.0 111.394 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.404 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.72 151.77 43.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.431 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.23 -23.43 72.57 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.351 2.034 . . . . 0.0 112.237 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.95 -5.51 53.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.477 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.73 5.78 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.888 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 389' ' ' LEU . . . . . 0.472 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.87 34.86 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.932 0.396 . . . . 0.0 110.607 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 390' ' ' LEU . . . . . 0.544 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.51 -15.76 5.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.674 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.29 148.74 23.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.551 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -73.58 -30.27 62.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.168 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 32.8 mm-40 -75.25 -47.76 26.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.998 0.428 . . . . 0.0 110.743 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.54 -44.25 91.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.826 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.37 -59.37 5.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.214 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.29 61.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.203 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.14 -41.02 67.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.402 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 398' ' ' ILE . . . . . 0.494 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.94 -53.69 15.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.474 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 399' ' ' VAL . . . . . 0.614 HG22 HD12 ' B' ' 417' ' ' ILE . 59.5 t -53.22 -46.98 57.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.801 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.92 3.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.517 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.73 -57.16 11.84 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.331 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.1 -32.84 15.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.385 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 403' ' ' ARG . . . . . 0.451 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.27 -57.39 4.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.12 -179.945 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.92 -33.59 64.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.15 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 405' ' ' GLU . . . . . 0.535 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.41 -47.17 44.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.95 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.78 -24.0 67.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.163 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.45 1.09 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.963 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.18 -17.14 12.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.821 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.66 -15.47 14.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.489 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.42 4.15 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.571 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 411' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.24 132.52 56.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.676 0.275 . . . . 0.0 111.052 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 412' ' ' VAL . . . . . 0.423 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.45 115.41 48.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.084 0.469 . . . . 0.0 110.549 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 413' ' ' LYS . . . . . 0.673 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.61 -62.06 1.99 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.168 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.96 -169.38 3.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.167 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 415' ' ' ILE . . . . . 0.614 HG23 HG12 ' B' ' 434' ' ' VAL . 48.5 mt -145.13 128.96 12.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.831 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 416' ' ' GLU . . . . . 0.433 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.9 108.82 18.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.733 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 417' ' ' ILE . . . . . 0.974 HG23 HG21 ' B' ' 432' ' ' ILE . 60.8 mt -128.55 108.57 19.01 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.644 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 418' ' ' PRO . . . . . 0.633 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.45 147.61 8.86 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.644 2.229 . . . . 0.0 112.916 -179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 419' ' ' ARG . . . . . 0.544 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.92 74.79 21.71 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.124 179.81 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -47.25 117.06 2.04 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.729 2.286 . . . . 0.0 112.472 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 421' ' ' VAL . . . . . 0.596 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.3 t -74.4 97.86 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.12 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.55 21.71 8.92 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.582 0.706 . . . . 0.0 109.374 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 423' ' ' GLY . . . . . 0.623 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.41 29.23 6.06 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.253 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 424' ' ' VAL . . . . . 0.596 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.48 -37.57 30.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.102 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.86 35.87 4.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.798 0.332 . . . . 0.0 111.809 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 426' ' ' VAL . . . . . 0.675 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.35 -44.68 47.72 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.775 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 427' ' ' PRO . . . . . 0.675 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.27 77.09 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.532 2.155 . . . . 0.0 111.08 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.27 -15.36 3.22 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.349 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.57 149.36 50.22 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.554 0.216 . . . . 0.0 110.864 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.17 5.06 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.842 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.4 126.04 44.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.856 0.36 . . . . 0.0 111.11 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 432' ' ' ILE . . . . . 0.974 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -130.95 172.84 15.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.28 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 433' ' ' PHE . . . . . 0.584 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.43 -176.36 2.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.981 0.419 . . . . 0.0 112.027 -178.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 434' ' ' VAL . . . . . 0.614 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.79 141.76 41.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.211 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 435' ' ' GLU . . . . . 0.492 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.36 108.39 17.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.849 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.72 168.4 12.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.255 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 437' ' ' THR . . . . . 0.673 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.91 -45.44 7.28 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.455 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.87 146.59 52.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.028 0.442 . . . . 0.0 111.249 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.15 -12.74 16.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.238 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -54.79 26.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.015 0.436 . . . . 0.0 110.087 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -75.08 -29.54 60.7 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.829 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.2 -31.71 72.27 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.197 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -78.61 -48.12 15.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.666 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.55 -12.11 59.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.73 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.83 -55.34 3.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.946 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 446' ' ' MET . . . . . 0.506 ' HB3' HD21 ' B' ' 378' ' ' LEU . 3.3 ptm -65.02 -25.86 68.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.22 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.8 -16.2 62.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.606 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.62 22.55 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.418 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 449' ' ' LEU . . . . . 0.407 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.66 -19.72 19.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.818 0.342 . . . . 0.0 110.99 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 16.0 m -72.85 125.94 28.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.206 -0.907 . . . . 0.0 111.038 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 98.5 -9.12 62.48 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.946 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 452' ' ' ARG . . . . . 0.433 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.83 -152.15 0.05 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.865 0.332 . . . . 0.0 110.553 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 453' ' ' LYS . . . . . 0.478 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.13 2.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.791 0.329 . . . . 0.0 111.263 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.33 -36.33 75.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.55 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.22 -50.92 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.754 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.23 24.89 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.834 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 457' ' ' ARG . . . . . 0.419 ' NE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.41 132.39 16.19 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.253 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 5.6 p -66.37 112.64 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.552 0.691 . . . . 0.0 110.994 -177.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 459' ' ' VAL . . . . . 0.612 HG11 ' HZ3' ' A' ' 22' ' ' TRP . 1.9 p -73.0 124.03 29.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.736 -174.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 460' ' ' VAL . . . . . 0.606 HG21 HG23 ' A' ' 53' ' ' ILE . 66.9 t -92.55 102.53 13.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.868 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 72.8 p -92.82 153.91 18.57 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.744 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 462' ' ' LYS . . . . . 0.41 ' HE2' ' HB2' ' B' ' 462' ' ' LYS . 0.1 OUTLIER -151.75 -168.41 3.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.082 0.468 . . . . 0.0 111.266 -177.714 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.44 146.91 37.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.411 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 464' ' ' CYS . . . . . 0.56 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 148.98 47.43 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.071 0.463 . . . . 0.0 111.363 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 465' ' ' ASP . . . . . 0.463 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.32 129.32 66.96 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.377 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 466' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.3 Cg_endo -53.96 -33.32 71.95 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.708 2.272 . . . . 0.0 112.148 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.51 7.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.385 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.81 68.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.289 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 469' ' ' TYR . . . . . 0.492 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.0 -51.28 70.33 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.161 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.38 -47.51 69.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.335 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 471' ' ' ARG . . . . . 0.448 HH11 ' HD2' ' B' ' 471' ' ' ARG . 0.0 OUTLIER -81.68 -2.18 49.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.438 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.1 20.77 8.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.007 0.432 . . . . 0.0 110.282 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 473' ' ' ASP . . . . . 0.436 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.62 -21.82 29.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.96 179.835 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 49.3 p90 . . . . . 0 N--CA 1.478 0.926 0 C-N-CA 124.652 1.181 . . . . 0.0 112.856 -175.274 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.6 p90 . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 120.449 0.166 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -57.29 115.49 2.54 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.993 2.462 . . . . 0.0 112.407 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.01 -166.7 1.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.836 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.31 51.96 12.22 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.935 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.43 -36.18 3.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.996 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.92 2.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.89 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.93 -54.26 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.734 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.13 13.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.57 24.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.816 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.84 19.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.038 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.602 ' HZ3' HG21 ' B' ' 459' ' ' VAL . 71.7 m95 -142.02 53.05 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.806 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.2 -156.59 0.13 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.889 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.467 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.27 -37.7 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.454 ' O ' ' HB ' ' A' ' 26' ' ' THR . 0.2 OUTLIER -114.72 125.72 54.05 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 118.826 -0.607 . . . . 0.0 110.607 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.454 ' HB ' ' O ' ' A' ' 25' ' ' ASP . 88.3 m . . . . . 0 N--CA 1.483 1.224 0 O-C-N 124.615 1.197 . . . . 0.0 110.778 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 CA--C 1.519 -0.248 0 CA-C-O 120.998 0.428 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.587 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 1.5 p -99.38 149.15 23.46 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.334 174.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.492 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -58.64 -31.32 68.02 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.329 -178.95 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.587 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.33 -45.18 61.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.33 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.16 -33.1 72.88 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.761 -177.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -61.24 -44.75 96.75 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.225 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.556 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.89 -43.39 98.93 Favored 'General case' 0 C--O 1.185 -2.316 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.248 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.553 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.26 -41.09 83.5 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 123.789 0.681 . . . . 0.0 111.626 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.79 -46.8 80.57 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.024 175.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.603 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 96.5 mt -64.49 -46.94 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.013 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 50' ' ' ARG . 34.9 m -68.04 -35.59 72.3 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.806 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.914 -177.084 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.12 -44.22 91.98 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.515 0.598 . . . . 0.0 110.349 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 1.7 pp -70.17 -28.55 65.42 Favored 'General case' 0 C--N 1.344 0.367 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.713 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.472 HE21 ' HA ' ' A' ' 54' ' ' VAL . 23.2 mt-30 -77.86 -34.68 51.64 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 120.873 0.368 . . . . 0.0 110.167 176.351 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.483 HD13 HD13 ' A' ' 113' ' ' ILE . 72.5 mt -62.9 -46.94 95.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.382 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.463 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.48 -41.28 84.84 Favored 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.703 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -68.31 -33.35 74.16 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.199 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.531 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.47 -44.98 77.28 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 173.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 m -65.63 -35.61 81.29 Favored 'General case' 0 N--CA 1.433 -1.305 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -178.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.49 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.82 -42.86 76.33 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 122.068 0.937 . . . . 0.0 108.495 176.158 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.531 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.71 -47.78 83.72 Favored 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.873 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.418 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.18 -28.86 63.49 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.856 177.028 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -67.97 -47.12 69.45 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.5 14.46 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -177.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.43 10.76 Favored Glycine 0 C--N 1.316 -0.57 0 C-N-CA 119.916 -1.135 . . . . 0.0 111.295 -177.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.34 88.85 6.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.258 0.552 . . . . 0.0 110.094 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 26.5 tp . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.544 176.935 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.1 t . . . . . 0 N--CA 1.435 -1.201 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.16 -52.52 16.21 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.247 -0.908 . . . . 0.0 109.692 -178.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.452 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.6 mp0 -53.3 -51.67 61.58 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.614 -1.63 . . . . 0.0 110.714 -178.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -66.78 -38.56 86.8 Favored 'General case' 0 N--CA 1.427 -1.59 0 CA-C-N 113.42 -1.718 . . . . 0.0 110.681 -177.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.523 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.89 -44.57 94.16 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.267 0.355 . . . . 0.0 110.379 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.728 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 16.0 m -69.01 -50.01 52.67 Favored 'General case' 0 N--CA 1.428 -1.561 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.649 179.027 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.449 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.4 -41.36 93.75 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -175.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.01 -39.15 90.02 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 110.381 -0.229 . . . . 0.0 110.381 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.527 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.15 -40.17 88.96 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.728 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.93 -41.02 97.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.719 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.12 -34.39 78.28 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.707 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.31 74.2 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.51 -48.84 75.95 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 175.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.554 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.32 -45.44 94.43 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.404 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.21 -37.51 85.6 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 123.603 0.761 . . . . 0.0 110.991 -178.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.84 -43.73 86.06 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.2 mt -72.21 -38.61 68.97 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.753 177.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.554 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.39 -50.86 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 120.464 0.173 . . . . 0.0 110.544 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.3 m -60.63 -39.58 88.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.221 0.534 . . . . 0.0 110.548 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.55 61.04 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.981 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.11 84.48 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.3 t -65.49 -36.88 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.19 0.519 . . . . 0.0 109.642 176.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.61 -40.77 80.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.171 0.51 . . . . 0.0 110.26 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.2 mt -71.33 -40.69 70.58 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.069 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ASN . . . . . 0.401 ' HA ' ' HD2' ' A' ' 121' ' ' PRO . 45.6 t30 -133.53 111.14 12.57 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.323 -0.398 . . . . 0.0 109.992 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 120' ' ' ASN . 59.9 Cg_endo -68.69 -22.72 37.06 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.885 2.39 . . . . 0.0 112.57 -178.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.24 0.04 55.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.35 0.595 . . . . 0.0 111.198 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.85 134.58 54.36 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.673 -178.169 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.36 109.18 62.91 Favored Pre-proline 0 CA--C 1.509 -0.615 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.308 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.29 157.97 59.52 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.247 1.965 . . . . 0.0 111.419 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.65 154.51 25.28 Favored 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 123.673 2.915 . . . . 0.0 111.737 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.31 69.38 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -173.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -85.45 34.11 0.57 Allowed 'General case' 0 CA--C 1.532 0.288 0 O-C-N 123.603 0.564 . . . . 0.0 111.224 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 56.3 t80 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.52 177.43 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 C--O 1.232 0.224 0 CA-C-O 120.523 0.135 . . . . 0.0 111.756 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 375' ' ' THR . . . . . 0.452 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -119.67 -71.33 0.74 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.124 177.903 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 376' ' ' GLU . . . . . 0.49 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.88 -45.96 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 377' ' ' VAL . . . . . 0.564 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.66 150.98 7.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.431 -179.411 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 378' ' ' LEU . . . . . 0.586 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.72 152.54 20.78 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.182 -179.026 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 379' ' ' CYS . . . . . 0.605 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.52 142.6 46.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.623 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.52 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.74 101.27 5.21 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.0 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 43.3 ttm -118.02 165.58 13.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.784 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.4 t30 59.07 51.22 7.3 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 123.635 0.584 . . . . 0.0 111.273 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 383' ' ' MET . . . . . 0.694 ' HB3' HG12 ' B' ' 459' ' ' VAL . 3.0 ptm -164.89 14.4 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.233 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 384' ' ' VAL . . . . . 0.744 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.3 125.09 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 0.0 111.42 179.865 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.2 mt -110.66 151.81 43.05 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.389 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -63.26 -23.49 72.39 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.293 1.995 . . . . 0.0 112.293 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.78 -5.5 53.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.552 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -110.15 -36.69 5.77 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.9 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 389' ' ' LEU . . . . . 0.481 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.99 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.997 0.427 . . . . 0.0 110.616 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.52 -15.81 5.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.652 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -98.31 148.83 23.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.565 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -73.63 -30.16 62.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.201 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.42 -47.59 26.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.001 0.429 . . . . 0.0 110.765 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.56 -44.33 91.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.748 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.27 -59.43 4.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.245 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.06 -27.31 61.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.185 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -40.99 67.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.405 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 398' ' ' ILE . . . . . 0.495 HD13 HG12 ' B' ' 384' ' ' VAL . 65.1 mt -74.88 -53.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.505 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 399' ' ' VAL . . . . . 0.621 HG22 HD12 ' B' ' 417' ' ' ILE . 59.6 t -53.31 -46.98 57.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.775 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.94 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.756 0.312 . . . . 0.0 111.548 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.65 -57.25 11.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.288 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.04 -32.9 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.391 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 403' ' ' ARG . . . . . 0.446 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.21 -57.31 4.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.824 0.345 . . . . 0.0 111.214 -179.989 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.95 -33.64 64.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.122 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 405' ' ' GLU . . . . . 0.55 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.53 -47.05 43.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.919 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.87 -23.97 67.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.148 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.07 30.41 1.09 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.981 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.15 -17.11 12.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -106.7 -15.48 14.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.535 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.37 4.12 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.627 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 411' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.26 132.51 56.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.612 0.244 . . . . 0.0 111.083 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 412' ' ' VAL . . . . . 0.422 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.51 115.47 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.101 0.477 . . . . 0.0 110.532 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 413' ' ' LYS . . . . . 0.7 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.8 mttt -56.6 -61.93 2.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.239 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.9 p -153.05 -169.38 3.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.171 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 415' ' ' ILE . . . . . 0.614 HG23 HG12 ' B' ' 434' ' ' VAL . 48.5 mt -145.12 128.96 12.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.848 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 416' ' ' GLU . . . . . 0.421 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.91 108.77 18.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.68 179.792 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 417' ' ' ILE . . . . . 1.006 HG23 HG21 ' B' ' 432' ' ' ILE . 60.7 mt -128.51 108.63 19.09 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.663 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 418' ' ' PRO . . . . . 0.637 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.61 147.7 9.2 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.587 2.191 . . . . 0.0 112.919 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.92 74.67 21.85 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.13 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -47.08 117.11 2.02 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.752 2.302 . . . . 0.0 112.407 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 421' ' ' VAL . . . . . 0.602 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.6 t -74.43 97.84 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.942 0.401 . . . . 0.0 111.2 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.51 21.85 9.01 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.49 0.662 . . . . 0.0 109.321 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 423' ' ' GLY . . . . . 0.649 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.28 29.26 6.09 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-N 114.755 -1.111 . . . . 0.0 111.346 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 424' ' ' VAL . . . . . 0.602 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.41 -37.6 31.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.152 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.84 35.86 4.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.817 0.342 . . . . 0.0 111.805 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 426' ' ' VAL . . . . . 0.671 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.37 -44.72 47.55 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.755 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 427' ' ' PRO . . . . . 0.671 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.24 77.11 0.33 Allowed 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.5 2.134 . . . . 0.0 111.053 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.31 -15.42 3.21 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.358 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.9 t -67.64 149.39 50.12 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.519 0.199 . . . . 0.0 110.766 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.51 -14.14 5.07 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.854 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.45 126.07 44.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.774 0.321 . . . . 0.0 111.072 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 432' ' ' ILE . . . . . 1.006 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.02 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.258 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 433' ' ' PHE . . . . . 0.605 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.38 2.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.032 0.444 . . . . 0.0 111.926 -178.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 434' ' ' VAL . . . . . 0.614 HG12 HG23 ' B' ' 415' ' ' ILE . 3.2 m -135.84 141.69 41.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.207 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 435' ' ' GLU . . . . . 0.491 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.38 108.63 17.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.833 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.82 168.41 12.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.239 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 437' ' ' THR . . . . . 0.7 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.1 p -94.93 -45.39 7.29 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.519 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.84 146.66 52.25 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.057 0.456 . . . . 0.0 111.216 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.26 -12.75 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.212 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.64 -54.86 25.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.156 0.503 . . . . 0.0 110.132 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -75.1 -29.44 60.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.859 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -31.72 72.3 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.22 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -78.64 -48.07 15.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.63 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.63 -12.04 59.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.762 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -56.03 3.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.914 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 446' ' ' MET . . . . . 0.586 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.6 OUTLIER -62.88 -28.07 69.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.464 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.67 -16.18 63.31 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.598 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.65 -8.59 22.51 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.408 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 449' ' ' LEU . . . . . 0.401 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.73 -19.7 19.47 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.764 0.316 . . . . 0.0 110.915 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 4.4 t -76.78 129.32 36.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.131 0.491 . . . . 0.0 110.956 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 97.08 -10.22 65.69 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.994 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 452' ' ' ARG . . . . . 0.424 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -76.09 -152.2 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 117.081 0.44 . . . . 0.0 110.492 178.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 453' ' ' LYS . . . . . 0.467 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.84 117.06 2.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.859 0.361 . . . . 0.0 111.306 -179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.17 -36.38 75.2 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.537 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.28 -50.96 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.788 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.17 24.94 0.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.704 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 457' ' ' ARG . . . . . 0.442 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.57 135.4 18.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.244 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 14.7 p -59.86 139.06 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.666 177.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 459' ' ' VAL . . . . . 0.694 HG12 ' HB3' ' B' ' 383' ' ' MET . 14.7 m -102.18 125.85 56.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.258 0.551 . . . . 0.0 111.843 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 460' ' ' VAL . . . . . 0.599 HG21 HG23 ' A' ' 53' ' ' ILE . 77.7 t -91.65 103.01 14.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.058 175.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 35.7 p -106.77 113.12 26.42 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.053 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 462' ' ' LYS . . . . . 0.408 ' HB2' ' H ' ' B' ' 463' ' ' TYR . 5.5 pttm -121.28 -157.33 0.72 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.343 0.592 . . . . 0.0 111.727 -178.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 463' ' ' TYR . . . . . 0.408 ' H ' ' HB2' ' B' ' 462' ' ' LYS . 1.3 m-85 -114.88 146.97 40.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.581 -172.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 464' ' ' CYS . . . . . 0.564 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.86 149.07 47.47 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.131 0.491 . . . . 0.0 111.284 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 465' ' ' ASP . . . . . 0.452 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.44 129.36 66.41 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.351 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 466' ' ' PRO . . . . . 0.49 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.3 Cg_endo -54.05 -33.32 72.96 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.763 2.309 . . . . 0.0 112.12 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.94 -58.52 7.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.445 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.41 -33.82 68.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.282 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 469' ' ' TYR . . . . . 0.491 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -59.96 -51.28 70.35 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.177 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.31 -47.55 69.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.358 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 471' ' ' ARG . . . . . 0.456 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.15 49.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.383 -179.862 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.09 20.84 8.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.917 0.389 . . . . 0.0 110.247 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 473' ' ' ASP . . . . . 0.456 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.78 -20.67 23.63 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.94 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.533 0.309 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.294 -178.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.477 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 15.0 m-85 . . . . . 0 C--O 1.231 0.092 0 N-CA-C 110.469 -0.197 . . . . 0.0 110.469 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 39.1 Cg_exo -56.54 115.53 2.54 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.287 2.658 . . . . 0.0 112.354 -173.405 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.01 -166.75 1.32 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.85 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.38 51.93 12.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.41 -36.23 3.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.974 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.84 2.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.92 -54.2 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.783 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.83 111.22 13.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.03 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.57 24.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.739 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.55 12.79 19.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.995 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.545 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.7 m95 -142.05 53.05 1.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.994 0.426 . . . . 0.0 110.83 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.2 -156.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.885 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.462 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.35 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.883 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.83 124.67 52.34 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-O 118.93 -0.557 . . . . 0.0 110.57 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.364 0 O-C-N 123.872 0.732 . . . . 0.0 110.041 172.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.493 ' HB3' ' HG3' ' A' ' 49' ' ' GLU . 3.8 mm? . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.769 0.318 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 54.7 p -79.19 159.07 27.53 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.506 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.11 -31.32 71.01 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 120.878 0.37 . . . . 0.0 111.305 -175.025 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -72.27 -45.12 61.48 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.3 -33.28 72.93 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.695 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.493 ' HG3' ' HB3' ' A' ' 44' ' ' LEU . 35.6 mt-10 -60.56 -45.21 94.75 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.145 177.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.556 ' O ' HG22 ' A' ' 54' ' ' VAL . 16.0 mmt180 -62.81 -43.32 99.11 Favored 'General case' 0 C--O 1.185 -2.327 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.211 177.501 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.541 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.42 -41.44 85.03 Favored 'General case' 0 C--N 1.32 -0.699 0 O-C-N 123.78 0.675 . . . . 0.0 111.632 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -65.3 -44.76 86.88 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.842 177.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.689 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 92.2 mt -69.18 -44.83 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.309 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.1 m -67.05 -35.49 74.66 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.71 0 CA-C-O 118.656 -0.688 . . . . 0.0 111.873 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.18 -44.77 92.17 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.595 0.634 . . . . 0.0 110.335 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 3.3 pp -72.12 -23.17 61.28 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.125 -178.582 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.409 HE21 HG22 ' A' ' 53' ' ' ILE . 40.9 mt-30 -85.86 -30.67 22.73 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.199 175.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.469 HD13 HD13 ' A' ' 113' ' ' ILE . 73.2 mt -62.59 -47.01 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.07 0.548 . . . . 0.0 110.411 172.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.483 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.34 -41.72 84.75 Favored 'General case' 0 CA--C 1.512 -0.482 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.667 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -68.53 -32.82 73.04 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.37 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.538 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.37 -45.1 77.27 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 173.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 m -65.47 -35.76 81.87 Favored 'General case' 0 N--CA 1.433 -1.288 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.499 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.73 -42.82 75.92 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.18 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.0 ttmt -61.83 -47.68 84.01 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.798 -1.546 . . . . 0.0 111.913 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.21 -28.86 63.45 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 119.758 -0.777 . . . . 0.0 111.888 176.966 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.92 -47.25 69.27 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.499 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.11 -17.51 14.46 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.926 -0.709 . . . . 0.0 112.904 -177.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.75 29.49 10.67 Favored Glycine 0 C--N 1.316 -0.528 0 C-N-CA 119.887 -1.149 . . . . 0.0 111.307 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.42 93.16 7.16 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.244 0.545 . . . . 0.0 110.261 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 23.3 tp . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.68 178.166 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.436 -1.138 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.19 -52.56 15.98 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.273 -0.892 . . . . 0.0 109.598 -178.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.447 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.6 mp0 -53.27 -51.75 61.27 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-N 113.616 -1.629 . . . . 0.0 110.614 -178.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.77 -38.61 86.92 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.482 -1.69 . . . . 0.0 110.626 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.53 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.92 -44.6 94.21 Favored 'General case' 0 CA--C 1.51 -0.563 0 O-C-N 123.182 0.302 . . . . 0.0 110.38 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.719 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.6 m -68.95 -50.03 52.8 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.679 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.455 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.37 -41.32 93.91 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 -175.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.97 -39.24 90.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.595 0.236 . . . . 0.0 110.373 178.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.534 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.17 -40.19 89.07 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.89 -41.08 97.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.7 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.06 -34.32 78.13 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.734 178.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.39 74.31 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 177.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.46 -48.8 76.21 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 175.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.552 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.23 -45.59 93.92 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.405 179.025 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.26 -37.41 85.35 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 123.579 0.751 . . . . 0.0 111.019 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.79 -43.81 85.85 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 177.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.5 mt -72.17 -38.67 69.07 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.157 -0.928 . . . . 0.0 110.75 177.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.35 -50.88 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 N-CA-C 110.488 -0.19 . . . . 0.0 110.488 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 96.0 m -60.79 -39.44 88.9 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.272 0.558 . . . . 0.0 110.589 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.614 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.88 -49.55 61.39 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.063 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.4 -37.11 84.51 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -177.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.1 t -65.57 -36.81 78.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.63 -40.78 80.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.206 0.527 . . . . 0.0 110.231 177.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.2 mt -71.4 -40.65 70.39 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.019 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ASN . . . . . 0.403 ' HA ' ' HD2' ' A' ' 121' ' ' PRO . 45.4 t30 -133.57 111.22 12.54 Favored Pre-proline 0 C--N 1.317 -0.834 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 120' ' ' ASN . 59.9 Cg_endo -68.79 -22.66 36.55 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.765 2.31 . . . . 0.0 112.531 -178.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.24 0.06 55.95 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.353 0.596 . . . . 0.0 111.175 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.91 134.64 54.42 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.61 -178.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.43 109.21 62.95 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.251 177.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.26 157.89 59.86 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.305 2.004 . . . . 0.0 111.516 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.57 154.5 24.88 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 123.603 2.869 . . . . 0.0 111.809 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.16 -28.59 67.42 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -173.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -71.61 -12.36 61.31 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -164.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 10.4 t80 . . . . . 0 C--N 1.327 -0.399 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.187 176.751 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.456 -0.723 0 CA-C-O 121.053 0.355 . . . . 0.0 112.363 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 375' ' ' THR . . . . . 0.456 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -127.5 -71.23 0.67 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.123 175.253 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 376' ' ' GLU . . . . . 0.481 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.85 -45.98 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 377' ' ' VAL . . . . . 0.558 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.99 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.465 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 378' ' ' LEU . . . . . 0.594 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.61 152.51 20.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.233 -179.057 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 379' ' ' CYS . . . . . 0.613 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.55 142.59 46.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.629 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.522 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.76 101.72 5.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.91 0.385 . . . . 0.0 110.958 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 85.3 mtp -119.12 166.43 12.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.97 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.7 51.26 7.88 Favored 'General case' 0 C--O 1.232 0.133 0 O-C-N 123.821 0.7 . . . . 0.0 111.345 -178.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 383' ' ' MET . . . . . 0.441 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.88 14.41 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.237 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 384' ' ' VAL . . . . . 0.739 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.3 125.01 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.382 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.413 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.61 151.78 43.01 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.468 179.425 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.2 -23.4 72.77 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.323 2.015 . . . . 0.0 112.279 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.9 -5.53 53.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.526 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.13 -36.71 5.77 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.848 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 389' ' ' LEU . . . . . 0.486 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.99 34.95 0.46 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.008 0.432 . . . . 0.0 110.669 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 390' ' ' LEU . . . . . 0.549 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.53 -15.72 5.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.693 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -98.34 148.77 23.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.553 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -73.55 -30.29 62.97 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.203 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -75.38 -47.58 26.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.768 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.63 -44.21 91.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.802 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.37 -59.47 4.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.193 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -27.32 61.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.234 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.17 -40.99 67.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.471 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 398' ' ' ILE . . . . . 0.489 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.91 -53.61 16.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.539 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 399' ' ' VAL . . . . . 0.613 HG22 HD12 ' B' ' 417' ' ' ILE . 59.3 t -53.4 -46.84 58.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.801 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.51 -59.94 3.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.52 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.68 -57.08 12.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.441 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.14 -32.86 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.346 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 403' ' ' ARG . . . . . 0.451 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.22 -57.42 4.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.766 0.317 . . . . 0.0 111.113 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.96 -33.68 64.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.127 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 405' ' ' GLU . . . . . 0.545 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 22.0 mm-40 -73.39 -47.02 45.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.981 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.85 -23.98 67.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.187 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.14 30.37 1.11 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.932 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.09 -17.12 12.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.45 14.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.493 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.17 -139.4 4.14 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.61 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 411' ' ' LEU . . . . . 0.409 ' HA ' HD13 ' B' ' 411' ' ' LEU . 1.6 mm? -114.25 132.47 56.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.677 0.275 . . . . 0.0 111.07 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 412' ' ' VAL . . . . . 0.425 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.4 p -117.43 115.45 48.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.02 0.438 . . . . 0.0 110.653 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 413' ' ' LYS . . . . . 0.697 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.62 -61.97 2.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.177 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.7 p -153.07 -169.44 3.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.049 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 415' ' ' ILE . . . . . 0.615 HG23 HG12 ' B' ' 434' ' ' VAL . 48.4 mt -145.0 128.89 12.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.945 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 416' ' ' GLU . . . . . 0.419 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.84 108.79 18.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.889 0.376 . . . . 0.0 110.702 179.811 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 417' ' ' ILE . . . . . 0.966 HG23 HG21 ' B' ' 432' ' ' ILE . 60.4 mt -128.49 108.59 19.11 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.675 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 418' ' ' PRO . . . . . 0.643 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.54 147.62 9.1 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 122.669 2.246 . . . . 0.0 112.855 -179.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 419' ' ' ARG . . . . . 0.549 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.87 74.64 22.05 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.107 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.16 117.07 2.02 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.732 2.288 . . . . 0.0 112.477 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 421' ' ' VAL . . . . . 0.597 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.6 t -74.39 97.82 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.178 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.62 21.77 9.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.535 0.684 . . . . 0.0 109.298 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 423' ' ' GLY . . . . . 0.644 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.23 29.25 6.11 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.377 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 424' ' ' VAL . . . . . 0.597 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.45 -37.47 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.9 35.81 4.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.745 0.307 . . . . 0.0 111.745 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 426' ' ' VAL . . . . . 0.666 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.31 -44.69 48.1 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.792 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 427' ' ' PRO . . . . . 0.666 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.9 Cg_endo -66.25 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.491 2.128 . . . . 0.0 111.088 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.26 -15.44 3.22 Favored Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.344 -178.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.58 149.38 50.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.68 0.276 . . . . 0.0 110.771 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.13 5.06 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.845 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 431' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -125.42 126.11 44.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.836 0.351 . . . . 0.0 111.108 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 432' ' ' ILE . . . . . 0.966 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -131.06 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.231 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 433' ' ' PHE . . . . . 0.613 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.47 -176.36 2.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.982 0.42 . . . . 0.0 111.939 -178.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 434' ' ' VAL . . . . . 0.615 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.87 141.75 41.02 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.145 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 435' ' ' GLU . . . . . 0.483 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.36 108.5 17.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.845 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.76 168.29 12.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.251 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 437' ' ' THR . . . . . 0.697 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.0 p -94.86 -45.42 7.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.517 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.89 146.57 52.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.99 0.424 . . . . 0.0 111.25 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.19 -12.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.236 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -54.86 25.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.149 0.5 . . . . 0.0 110.043 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.13 -29.5 60.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.829 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.12 -31.86 72.37 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.19 179.192 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -78.61 -48.01 15.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.641 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.63 -12.02 59.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.738 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -55.73 3.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.902 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 446' ' ' MET . . . . . 0.594 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.3 OUTLIER -63.69 -27.46 69.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.25 -179.678 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.87 -16.33 63.23 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.574 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.64 22.53 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.425 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.2 mt -95.61 -19.52 19.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.784 0.326 . . . . 0.0 111.004 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 1.7 t -72.37 132.28 43.74 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.894 176.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 92.45 -9.55 75.78 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.299 178.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 452' ' ' ARG . . . . . 0.422 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.07 -152.25 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 117.313 0.556 . . . . 0.0 110.525 178.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 453' ' ' LYS . . . . . 0.462 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.8 117.1 2.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.884 0.373 . . . . 0.0 111.331 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.27 -36.32 75.33 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.549 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.833 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.19 24.91 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.731 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 457' ' ' ARG . . . . . 0.441 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.48 135.73 19.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.301 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 14.8 p -60.83 137.28 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.968 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 459' ' ' VAL . . . . . 0.402 HG12 HG23 ' B' ' 461' ' ' THR . 45.0 t -99.77 115.36 40.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.414 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 460' ' ' VAL . . . . . 0.592 HG21 HG23 ' A' ' 53' ' ' ILE . 39.7 t -84.88 102.76 11.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.959 176.015 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 461' ' ' THR . . . . . 0.402 HG23 HG12 ' B' ' 459' ' ' VAL . 21.4 p -102.68 123.13 45.8 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.377 -177.189 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 462' ' ' LYS . . . . . 0.412 ' HE2' HD11 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -130.56 -159.38 0.96 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.279 0.562 . . . . 0.0 111.758 -179.485 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -114.7 147.0 40.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.667 -171.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 464' ' ' CYS . . . . . 0.558 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.9 148.98 47.36 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.068 0.461 . . . . 0.0 111.382 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 465' ' ' ASP . . . . . 0.456 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.36 129.37 66.64 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.378 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 466' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.1 -33.24 73.14 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.677 2.251 . . . . 0.0 112.07 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.46 7.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.43 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.82 68.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.281 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 469' ' ' TYR . . . . . 0.483 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.03 -51.25 70.45 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.156 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -53.32 -47.52 69.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.4 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 471' ' ' ARG . . . . . 0.456 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.75 -2.06 49.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.415 -179.895 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.1 20.8 8.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.876 0.37 . . . . 0.0 110.236 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 473' ' ' ASP . . . . . 0.456 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.83 -19.85 19.58 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.927 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 . . . . . 0 N--CA 1.477 0.908 0 C-N-CA 123.014 0.526 . . . . 0.0 112.043 179.31 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.363 0.125 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -56.65 115.65 2.63 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 123.04 2.493 . . . . 0.0 112.205 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.0 -166.77 1.33 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.903 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.39 51.91 12.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.908 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.36 -36.18 3.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.05 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.84 91.91 2.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.87 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.89 -54.27 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.796 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.82 111.19 13.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.941 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.61 24.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.726 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.67 12.83 19.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.94 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.558 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.7 m95 -142.02 53.07 1.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.773 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.25 -156.56 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.467 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.31 -37.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.857 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.64 119.65 37.48 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.518 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.51 0 O-C-N 123.982 0.802 . . . . 0.0 109.854 -171.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 44' ' ' LEU . 3.2 mm? . . . . . 0 C--O 1.233 0.195 0 CA-C-O 121.015 0.436 . . . . 0.0 111.659 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.502 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 16.1 p -89.75 158.0 17.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.163 174.28 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.513 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.78 -31.43 71.63 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 120.956 0.407 . . . . 0.0 111.317 -176.107 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.502 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.27 -45.22 61.05 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -69.14 -33.03 72.8 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.796 -177.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -62.2 -42.91 99.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.419 178.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.555 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -64.03 -43.36 95.8 Favored 'General case' 0 C--O 1.185 -2.302 0 CA-C-O 118.803 -0.618 . . . . 0.0 110.274 176.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.56 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.35 -41.87 85.66 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 123.792 0.683 . . . . 0.0 111.583 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -65.73 -43.19 89.79 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.744 0.307 . . . . 0.0 110.999 176.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.779 ' HA ' HD23 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -73.22 -38.49 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.465 -178.708 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 51' ' ' ALA . 35.1 m -70.34 -35.52 62.93 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.788 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.881 177.62 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.13 -43.89 92.02 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.591 0.632 . . . . 0.0 110.275 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.779 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.6 OUTLIER -65.24 -34.11 77.58 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.946 178.069 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.424 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 48.8 tt0 -80.87 -29.23 35.77 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.467 HD13 HD13 ' A' ' 113' ' ' ILE . 73.0 mt -65.08 -47.06 89.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.348 174.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.4 -41.93 84.11 Favored 'General case' 0 CA--C 1.513 -0.45 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.697 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -58.84 -43.78 90.79 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 124.887 1.367 . . . . 0.0 110.843 176.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.527 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -66.01 -44.94 83.31 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.401 178.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.0 m -65.56 -35.7 81.62 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.503 ' O ' HG22 ' A' ' 67' ' ' THR . 39.3 ttp180 -55.89 -42.68 76.34 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 122.069 0.937 . . . . 0.0 108.509 176.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.527 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.84 -47.78 83.53 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.836 -1.529 . . . . 0.0 111.883 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.412 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.16 -28.91 63.54 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 119.754 -0.778 . . . . 0.0 111.791 177.069 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -68.02 -47.1 69.38 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.503 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.11 -17.59 14.43 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 120.002 -0.679 . . . . 0.0 112.821 -177.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.8 29.44 10.66 Favored Glycine 0 C--N 1.315 -0.631 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.252 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.27 92.56 6.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.174 0.511 . . . . 0.0 110.268 -179.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.437 HD11 HD21 ' A' ' 105' ' ' LEU . 3.0 mm? . . . . . 0 N--CA 1.45 -0.435 0 CA-C-N 114.009 -1.45 . . . . 0.0 109.884 175.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.436 -1.157 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.15 -52.51 16.31 Favored 'General case' 0 C--N 1.306 -1.323 0 O-C-N 121.237 -0.914 . . . . 0.0 109.604 -178.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.4 mp0 -53.19 -51.77 61.03 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.704 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.68 -38.74 87.42 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 113.355 -1.748 . . . . 0.0 110.666 -177.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.52 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.93 -44.48 94.32 Favored 'General case' 0 CA--C 1.511 -0.537 0 O-C-N 123.17 0.294 . . . . 0.0 110.384 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.731 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.7 m -68.94 -50.13 51.96 Favored 'General case' 0 N--CA 1.429 -1.521 0 C-N-CA 120.104 -0.638 . . . . 0.0 110.644 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.41 -41.27 93.76 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -175.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.9 -39.27 90.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.588 0.232 . . . . 0.0 110.384 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.527 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.2 -40.13 88.99 Favored 'General case' 0 C--O 1.225 -0.235 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.731 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.8 mt -64.04 -40.98 97.51 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.673 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.04 -34.35 78.23 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.785 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.4 74.32 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 177.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.5 -48.82 76.04 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 175.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.547 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.21 -45.54 94.16 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.396 179.047 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.26 -37.4 85.33 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.016 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.82 -43.8 86.0 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 66.1 mt -72.19 -38.64 69.03 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.723 177.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.44 -50.77 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-O 120.474 0.178 . . . . 0.0 110.554 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.8 m -60.79 -39.49 89.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.301 0.572 . . . . 0.0 110.544 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.601 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.9 -49.63 60.88 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.015 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.35 -37.14 84.65 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -177.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.7 t -65.54 -36.83 78.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.61 -40.79 80.23 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.23 0.538 . . . . 0.0 110.213 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.5 mt -71.41 -40.69 70.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.006 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.57 111.24 12.54 Favored Pre-proline 0 C--N 1.315 -0.894 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.011 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.76 -22.7 36.69 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.836 2.357 . . . . 0.0 112.516 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.29 0.12 55.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.379 0.609 . . . . 0.0 111.203 -177.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.86 134.62 54.43 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.66 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.4 109.08 62.81 Favored Pre-proline 0 CA--C 1.509 -0.609 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.302 177.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -68.26 157.92 59.72 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.275 1.984 . . . . 0.0 111.503 178.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.58 154.5 24.89 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 123.615 2.877 . . . . 0.0 111.786 177.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.93 -30.17 69.41 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -173.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -75.96 -13.21 60.24 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 123.451 0.469 . . . . 0.0 111.748 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 58.4 t80 . . . . . 0 N--CA 1.465 0.298 0 CA-C-O 121.0 0.429 . . . . 0.0 111.491 -179.41 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo . . . . . 0 CA--C 1.531 0.329 0 N-CA-C 113.846 0.672 . . . . 0.0 113.846 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 375' ' ' THR . . . . . 0.462 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -115.63 -71.39 0.74 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.143 173.057 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 376' ' ' GLU . . . . . 0.486 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.92 0.01 OUTLIER 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 377' ' ' VAL . . . . . 0.565 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.64 151.0 7.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.432 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 378' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.66 152.58 20.79 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.197 -179.055 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 379' ' ' CYS . . . . . 0.599 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.64 142.57 46.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.599 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.52 HD23 HG22 ' B' ' 461' ' ' THR . 5.3 mt -132.76 101.18 5.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 381' ' ' MET . . . . . 0.455 ' HB3' ' HB ' ' B' ' 460' ' ' VAL . 18.3 ttp -116.65 165.92 12.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.596 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 382' ' ' ASN . . . . . 0.493 HD21 ' NH1' ' A' ' 50' ' ' ARG . 13.3 t30 58.31 51.13 8.69 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 123.536 0.523 . . . . 0.0 111.256 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 383' ' ' MET . . . . . 0.43 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.81 14.32 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.271 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 384' ' ' VAL . . . . . 0.712 HG21 HG23 ' B' ' 432' ' ' ILE . 0.4 OUTLIER -152.3 125.13 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.829 0.347 . . . . 0.0 111.326 179.878 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.415 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.67 151.74 43.01 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.406 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.1 -23.46 73.38 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.265 1.976 . . . . 0.0 112.352 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.86 -5.53 53.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.04 -36.69 5.79 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.909 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 389' ' ' LEU . . . . . 0.473 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -83.05 34.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.946 0.403 . . . . 0.0 110.603 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 390' ' ' LEU . . . . . 0.528 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.47 -15.73 5.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.726 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -98.28 148.74 23.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.582 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -73.56 -30.34 62.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.186 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.31 -47.68 26.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.729 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.48 -44.33 91.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.801 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -56.4 -59.4 5.02 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.211 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -27.35 61.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.23 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -40.99 67.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.42 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 398' ' ' ILE . . . . . 0.496 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.9 -53.68 15.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.513 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 399' ' ' VAL . . . . . 0.628 HG22 HD12 ' B' ' 417' ' ' ILE . 59.5 t -53.34 -46.86 58.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.795 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.51 -59.92 3.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.516 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.68 -57.13 11.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.385 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.14 -32.83 15.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.375 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 403' ' ' ARG . . . . . 0.455 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.21 -57.43 4.5 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.746 0.307 . . . . 0.0 111.145 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.88 -33.64 64.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.177 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 405' ' ' GLU . . . . . 0.558 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.5 -47.02 44.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.978 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.83 -23.97 67.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.164 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.04 30.27 1.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.972 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.11 -17.07 12.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.89 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.67 -15.52 14.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.52 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.41 4.14 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.601 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 411' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.25 132.47 56.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.319 . . . . 0.0 111.086 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 412' ' ' VAL . . . . . 0.426 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.39 115.49 48.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.061 0.457 . . . . 0.0 110.593 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 413' ' ' LYS . . . . . 0.694 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.63 -61.98 2.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.184 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.9 p -152.96 -169.35 3.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.113 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 415' ' ' ILE . . . . . 0.615 HG23 HG12 ' B' ' 434' ' ' VAL . 48.8 mt -145.2 128.92 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.859 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 416' ' ' GLU . . . . . 0.437 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.8 108.8 18.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.746 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 417' ' ' ILE . . . . . 0.969 HG23 HG21 ' B' ' 432' ' ' ILE . 61.1 mt -128.53 108.59 19.03 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.643 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 418' ' ' PRO . . . . . 0.649 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.48 147.56 8.98 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.689 2.259 . . . . 0.0 112.903 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 419' ' ' ARG . . . . . 0.528 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.83 74.74 22.11 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.158 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -47.19 117.1 2.05 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.758 2.305 . . . . 0.0 112.475 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 421' ' ' VAL . . . . . 0.594 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.5 t -74.39 97.81 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.189 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.64 21.73 9.08 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.535 0.683 . . . . 0.0 109.29 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 423' ' ' GLY . . . . . 0.639 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.31 29.29 6.07 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.291 -179.047 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 424' ' ' VAL . . . . . 0.594 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.45 -37.51 30.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.17 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.85 35.78 4.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.793 0.33 . . . . 0.0 111.771 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 426' ' ' VAL . . . . . 0.675 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.32 -44.69 47.98 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.74 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 427' ' ' PRO . . . . . 0.675 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.9 Cg_endo -66.26 77.05 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.477 2.118 . . . . 0.0 111.102 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.34 -15.43 3.2 Favored Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.339 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.54 149.4 50.19 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.596 0.236 . . . . 0.0 110.729 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.5 -14.24 5.06 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.841 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.41 126.13 44.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.819 0.342 . . . . 0.0 111.024 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 432' ' ' ILE . . . . . 0.969 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.04 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.264 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 433' ' ' PHE . . . . . 0.599 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.51 -176.4 2.81 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.981 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 434' ' ' VAL . . . . . 0.615 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.73 141.74 41.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.193 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 435' ' ' GLU . . . . . 0.484 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.37 108.48 17.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.778 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.78 168.32 12.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.256 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 437' ' ' THR . . . . . 0.694 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.91 -45.34 7.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.474 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.91 146.6 52.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.004 0.431 . . . . 0.0 111.215 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.22 -12.78 16.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.215 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.54 -54.79 26.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.086 0.469 . . . . 0.0 110.189 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -75.18 -29.54 60.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.789 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 442' ' ' CYS . . . . . 0.418 ' O ' ' HG2' ' B' ' 446' ' ' MET . 0.3 OUTLIER -62.13 -31.76 72.27 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.185 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -78.68 -48.08 15.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.611 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.58 -11.99 59.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.776 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.86 -55.9 3.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.939 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 446' ' ' MET . . . . . 0.602 ' HB3' HD21 ' B' ' 378' ' ' LEU . 1.9 ptp -62.87 -29.17 70.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.142 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -68.41 -16.2 63.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.603 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.63 -8.62 22.52 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.367 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 449' ' ' LEU . . . . . 0.409 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.69 -19.65 19.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.711 0.291 . . . . 0.0 110.925 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 450' ' ' THR . . . . . 0.537 HG23 ' O ' ' B' ' 446' ' ' MET . 39.9 p -70.02 132.22 45.56 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.087 175.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.31 -9.19 78.08 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.384 176.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 452' ' ' ARG . . . . . 0.432 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.14 -152.2 0.04 OUTLIER 'General case' 0 C--O 1.232 0.153 0 CA-C-N 117.322 0.561 . . . . 0.0 110.517 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 453' ' ' LYS . . . . . 0.467 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.85 117.08 2.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.359 . . . . 0.0 111.324 -179.866 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.29 -36.36 75.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.494 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.21 -50.91 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.817 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.22 24.89 0.3 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.783 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 457' ' ' ARG . . . . . 0.43 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.45 136.54 19.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.253 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 8.2 p -56.47 140.17 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.994 176.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 50.7 t -101.73 121.67 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -174.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 460' ' ' VAL . . . . . 0.744 HG22 HG12 ' A' ' 53' ' ' ILE . 33.9 t -83.33 100.41 6.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.121 175.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 461' ' ' THR . . . . . 0.52 HG22 HD23 ' B' ' 380' ' ' LEU . 8.2 p -105.62 111.55 24.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.872 0.368 . . . . 0.0 110.94 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 462' ' ' LYS . . . . . 0.432 ' HB2' ' HE3' ' B' ' 462' ' ' LYS . 31.7 mtmt -117.65 -164.59 1.01 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.28 0.562 . . . . 0.0 111.271 -177.28 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -111.75 147.07 36.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.549 178.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 464' ' ' CYS . . . . . 0.565 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.91 148.9 47.29 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.003 0.43 . . . . 0.0 111.373 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 465' ' ' ASP . . . . . 0.462 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.35 129.43 66.41 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.366 -179.858 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 466' ' ' PRO . . . . . 0.486 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.04 -33.4 73.19 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.782 2.321 . . . . 0.0 112.035 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.99 -58.53 7.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.396 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.76 68.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.26 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 469' ' ' TYR . . . . . 0.484 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.01 -51.27 70.38 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.162 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.39 -47.54 69.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 471' ' ' ARG . . . . . 0.438 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.64 -2.16 49.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.42 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.78 8.74 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.913 0.387 . . . . 0.0 110.223 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 473' ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' B' ' 474' ' ' PHE . 0.3 OUTLIER -56.66 -20.13 19.88 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.981 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 474' ' ' PHE . . . . . 0.482 ' HB2' ' O ' ' B' ' 473' ' ' ASP . 3.3 m-30 . . . . . 0 N--CA 1.471 0.59 0 C-N-CA 123.331 0.652 . . . . 0.0 111.319 -178.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.142 0.02 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.07 115.51 2.55 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.624 2.216 . . . . 0.0 112.378 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.05 -166.77 1.32 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.4 51.93 12.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.894 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.42 -36.19 3.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.952 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.75 91.9 2.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.9 -54.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.832 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.22 13.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.96 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.99 125.56 24.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.713 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.72 19.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.024 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TRP . . . . . 0.568 ' HZ3' HG11 ' B' ' 459' ' ' VAL . 71.8 m95 -141.97 53.09 1.48 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.798 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.2 -156.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.858 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.486 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.36 -37.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.71 120.6 40.64 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 118.956 -0.545 . . . . 0.0 110.598 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.0 p . . . . . 0 C--N 1.329 -0.316 0 O-C-N 123.63 0.581 . . . . 0.0 111.238 -178.344 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 mm? . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.723 0.297 . . . . 0.0 111.358 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.507 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.6 p -95.12 156.62 16.24 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.159 175.077 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.518 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.21 -31.35 71.12 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 120.889 0.376 . . . . 0.0 111.301 -174.663 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.437 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.36 -45.13 61.22 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.23 -33.05 72.69 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.731 -177.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 45' ' ' THR . 44.5 mt-10 -60.55 -45.3 94.38 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.221 177.65 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.552 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.05 -43.34 98.93 Favored 'General case' 0 C--O 1.185 -2.318 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.29 177.504 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.556 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.33 -40.77 83.01 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 123.771 0.669 . . . . 0.0 111.571 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -67.55 -46.48 72.63 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 122.175 -0.328 . . . . 0.0 110.759 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.742 HG23 HG21 ' B' ' 460' ' ' VAL . 87.2 mt -58.52 -51.16 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 110.751 176.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.556 HG22 ' HA ' ' A' ' 51' ' ' ALA . 35.0 m -66.67 -35.6 75.2 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.744 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.919 -175.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.16 -44.91 92.14 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.537 0.608 . . . . 0.0 110.312 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.487 ' HA ' ' HG2' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -70.15 -28.08 65.06 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.828 179.358 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.5 ' HB3' ' CD1' ' A' ' 112' ' ' LEU . 15.8 mt-30 -74.34 -38.49 63.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.231 174.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.481 HD13 HD13 ' A' ' 113' ' ' ILE . 72.7 mt -62.53 -47.04 94.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 114.871 -1.058 . . . . 0.0 110.374 178.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.4 -41.51 84.84 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.689 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -67.42 -34.36 77.08 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.257 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.53 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.18 -44.91 78.49 Favored 'General case' 0 C--O 1.207 -1.175 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 174.17 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 m -65.67 -35.72 81.58 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -178.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.497 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.76 -42.8 75.98 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 122.111 0.958 . . . . 0.0 108.516 176.181 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.53 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.79 -47.73 83.84 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 113.797 -1.547 . . . . 0.0 111.898 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.418 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.21 -28.89 63.47 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.812 177.077 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -68.05 -47.06 69.38 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.497 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.52 14.45 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.971 -0.692 . . . . 0.0 112.846 -177.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.74 29.44 10.74 Favored Glycine 0 C--N 1.315 -0.592 0 C-N-CA 119.87 -1.157 . . . . 0.0 111.285 -177.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.44 90.05 6.68 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.163 0.506 . . . . 0.0 110.147 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.0 tp . . . . . 0 C--N 1.331 -0.201 0 O-C-N 121.692 -0.63 . . . . 0.0 112.3 -170.832 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.437 -1.097 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -72.12 -52.46 16.64 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.27 -0.894 . . . . 0.0 109.7 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.463 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.5 mp0 -53.23 -51.76 61.12 Favored 'General case' 0 CA--C 1.502 -0.889 0 CA-C-N 113.612 -1.631 . . . . 0.0 110.702 -178.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.69 -38.69 87.28 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 113.428 -1.714 . . . . 0.0 110.632 -177.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ARG . . . . . 0.529 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.95 -44.5 94.34 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 123.154 0.284 . . . . 0.0 110.369 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.718 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.3 m -68.91 -50.11 52.3 Favored 'General case' 0 N--CA 1.428 -1.538 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.677 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.451 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.41 -41.3 93.78 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -175.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.04 -39.17 89.95 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 178.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.535 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.25 -40.11 89.13 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.718 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.3 mt -63.93 -41.04 97.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.679 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.05 -34.4 78.32 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.805 178.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.48 -34.33 74.19 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 177.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.48 -48.83 76.05 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 175.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.545 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.38 -45.48 94.2 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.352 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.3 -37.4 85.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 123.53 0.732 . . . . 0.0 111.027 -178.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.83 -43.72 85.99 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.5 ' CD1' ' HB3' ' A' ' 57' ' ' GLN . 65.7 mt -72.2 -38.63 68.99 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.771 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.545 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.36 -50.86 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 CA-C-O 120.538 0.208 . . . . 0.0 110.552 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.8 m -60.72 -39.53 88.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.289 0.566 . . . . 0.0 110.529 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.608 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.54 61.12 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.024 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.34 -37.15 84.68 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -177.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.8 t -65.58 -36.83 78.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.74 80.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.245 0.545 . . . . 0.0 110.248 177.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.6 mt -71.43 -40.59 70.33 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.055 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -133.62 111.15 12.47 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.011 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.68 -22.72 37.14 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.819 2.346 . . . . 0.0 112.577 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.28 0.04 56.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.137 -177.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.89 134.64 54.44 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.627 -178.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -105.37 109.23 62.97 Favored Pre-proline 0 CA--C 1.51 -0.583 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.211 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.32 157.88 59.94 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.293 1.995 . . . . 0.0 111.553 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.63 154.51 25.14 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 123.603 2.869 . . . . 0.0 111.711 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.03 -28.46 67.41 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -173.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -73.6 -8.62 56.71 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.728 0.642 . . . . 0.0 111.868 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 87.3 t80 . . . . . 0 C--O 1.232 0.153 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 176.77 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo . . . . . 0 CA--C 1.532 0.39 0 N-CA-C 113.662 0.601 . . . . 0.0 113.662 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 375' ' ' THR . . . . . 0.464 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -117.78 -71.32 0.74 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.168 174.196 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 376' ' ' GLU . . . . . 0.49 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.88 0.01 OUTLIER 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.071 0.396 . . . . 0.0 112.071 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 377' ' ' VAL . . . . . 0.564 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.64 150.97 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.112 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.448 -179.48 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 378' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.65 152.51 20.83 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.179 -179.052 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 379' ' ' CYS . . . . . 0.603 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.49 142.5 46.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.636 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.518 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.73 101.64 5.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.897 0.379 . . . . 0.0 111.046 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 381' ' ' MET . . . . . 0.479 ' O ' HG23 ' B' ' 459' ' ' VAL . 27.0 ttp -117.97 165.13 14.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.604 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 382' ' ' ASN . . . . . 0.433 ' HA ' HD21 ' B' ' 382' ' ' ASN . 0.3 OUTLIER 58.85 51.19 7.69 Favored 'General case' 0 C--N 1.34 0.158 0 O-C-N 123.508 0.505 . . . . 0.0 111.387 -179.385 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 383' ' ' MET . . . . . 0.439 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.85 14.38 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.228 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 384' ' ' VAL . . . . . 0.71 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.29 125.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.885 0.374 . . . . 0.0 111.315 179.878 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.416 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.76 151.72 43.05 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.402 179.474 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.15 -23.44 73.11 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.317 2.011 . . . . 0.0 112.297 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.91 -5.49 53.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.52 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.03 -36.77 5.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.911 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 389' ' ' LEU . . . . . 0.481 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.94 34.92 0.46 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.984 0.421 . . . . 0.0 110.684 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.51 -15.7 5.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.695 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.41 148.72 23.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.521 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -73.52 -30.28 63.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.176 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.28 -47.73 26.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.69 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.58 -44.3 91.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.71 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.33 -59.39 5.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.184 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.26 61.56 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.202 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.2 -41.05 67.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.39 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 398' ' ' ILE . . . . . 0.492 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.91 -53.65 16.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.5 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 399' ' ' VAL . . . . . 0.618 HG22 HD12 ' B' ' 417' ' ' ILE . 59.8 t -53.28 -46.96 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.805 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.46 -59.97 3.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.517 -179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.64 -57.18 11.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.356 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.12 -32.83 15.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.361 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 403' ' ' ARG . . . . . 0.439 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.22 -57.38 4.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.165 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.91 -33.64 64.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.198 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 405' ' ' GLU . . . . . 0.558 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.46 -47.03 44.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.963 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.84 -24.0 67.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.154 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.04 30.34 1.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.957 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.07 -17.16 12.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.93 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.72 -15.39 14.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.503 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.13 -139.43 4.16 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.574 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.26 132.46 56.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.726 0.298 . . . . 0.0 111.079 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 412' ' ' VAL . . . . . 0.424 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.38 115.46 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.052 0.453 . . . . 0.0 110.6 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 413' ' ' LYS . . . . . 0.665 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.62 -62.04 2.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.136 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.98 -169.36 3.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.147 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 415' ' ' ILE . . . . . 0.603 HG23 HG12 ' B' ' 434' ' ' VAL . 48.2 mt -145.1 128.97 12.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.876 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 416' ' ' GLU . . . . . 0.434 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.88 108.83 18.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.674 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 417' ' ' ILE . . . . . 0.986 HG23 HG21 ' B' ' 432' ' ' ILE . 60.5 mt -128.58 108.5 18.94 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.663 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 418' ' ' PRO . . . . . 0.63 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.47 147.62 8.9 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.621 2.214 . . . . 0.0 112.886 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.91 74.74 21.82 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.141 179.841 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -47.17 117.08 2.03 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.729 2.286 . . . . 0.0 112.497 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 421' ' ' VAL . . . . . 0.598 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.0 t -74.44 97.86 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.128 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.59 21.77 9.04 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.559 0.695 . . . . 0.0 109.358 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 423' ' ' GLY . . . . . 0.618 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.25 29.31 6.09 Favored Glycine 0 N--CA 1.444 -0.819 0 CA-C-N 114.79 -1.096 . . . . 0.0 111.306 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 424' ' ' VAL . . . . . 0.598 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.51 -37.5 30.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.152 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.92 35.93 4.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.777 0.323 . . . . 0.0 111.741 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 426' ' ' VAL . . . . . 0.666 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.37 -44.68 47.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.759 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 427' ' ' PRO . . . . . 0.666 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.34 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.488 2.125 . . . . 0.0 111.05 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.3 -15.37 3.22 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.341 -178.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.54 149.31 50.31 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.649 0.261 . . . . 0.0 110.743 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.61 -14.31 5.03 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.838 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 126.06 44.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.839 0.352 . . . . 0.0 111.111 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 432' ' ' ILE . . . . . 0.986 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -130.96 172.91 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.252 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 433' ' ' PHE . . . . . 0.603 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.37 2.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.986 0.422 . . . . 0.0 111.966 -178.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 434' ' ' VAL . . . . . 0.603 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.79 141.72 41.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.179 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 435' ' ' GLU . . . . . 0.491 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.39 108.47 17.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.836 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.74 168.35 12.56 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.205 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 437' ' ' THR . . . . . 0.665 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.96 -45.36 7.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.458 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.93 146.54 52.16 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.041 0.448 . . . . 0.0 111.25 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.14 -12.8 16.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.26 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -54.89 25.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.141 0.496 . . . . 0.0 110.121 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -75.06 -29.53 60.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.858 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -31.79 72.35 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.094 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -78.63 -48.08 15.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.611 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.54 -12.1 59.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.753 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -55.69 3.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.96 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 446' ' ' MET . . . . . 0.583 ' O ' HG23 ' B' ' 450' ' ' THR . 3.6 ptm -63.74 -28.15 69.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.038 -179.518 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.06 -16.28 63.66 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.54 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.56 -8.62 22.64 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.487 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 449' ' ' LEU . . . . . 0.4 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.3 mt -95.73 -19.87 19.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.739 0.304 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 450' ' ' THR . . . . . 0.583 HG23 ' O ' ' B' ' 446' ' ' MET . 43.2 p -70.02 131.74 44.83 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.884 175.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.81 -9.46 76.74 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.531 177.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 452' ' ' ARG . . . . . 0.424 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.15 -152.16 0.04 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 117.252 0.526 . . . . 0.0 110.505 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 453' ' ' LYS . . . . . 0.486 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.84 117.01 2.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.855 0.359 . . . . 0.0 111.34 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.17 -36.41 75.26 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.538 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.817 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.32 24.84 0.3 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.817 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 457' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.46 134.58 18.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.294 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 6.6 p -66.3 129.69 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.871 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 459' ' ' VAL . . . . . 0.568 HG11 ' HZ3' ' A' ' 22' ' ' TRP . 2.0 p -94.48 122.98 46.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.521 -175.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 460' ' ' VAL . . . . . 0.742 HG21 HG23 ' A' ' 53' ' ' ILE . 41.2 t -92.53 92.91 3.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.35 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 76.7 p -83.32 142.67 30.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.301 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 462' ' ' LYS . . . . . 0.438 ' HE2' ' HB2' ' B' ' 462' ' ' LYS . 1.3 ttmm -139.01 -164.18 1.61 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.2 0.524 . . . . 0.0 111.337 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.73 146.95 37.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.512 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 464' ' ' CYS . . . . . 0.564 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 148.99 47.45 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.999 0.428 . . . . 0.0 111.456 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 465' ' ' ASP . . . . . 0.464 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.35 129.39 66.6 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.337 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 466' ' ' PRO . . . . . 0.49 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.12 -33.22 73.26 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.655 2.236 . . . . 0.0 112.103 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.07 -58.39 8.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.453 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.51 -33.74 68.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.233 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 469' ' ' TYR . . . . . 0.491 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.07 -51.19 70.69 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.209 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.4 -47.49 69.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.332 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 471' ' ' ARG . . . . . 0.441 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.73 -2.11 49.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.399 -179.886 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.07 20.78 8.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.905 0.383 . . . . 0.0 110.285 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 473' ' ' ASP . . . . . 0.515 ' O ' ' HB2' ' B' ' 474' ' ' PHE . 0.3 OUTLIER -56.75 -20.48 22.39 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.959 179.927 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 474' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' B' ' 473' ' ' ASP . 2.8 m-30 . . . . . 0 N--CA 1.472 0.654 0 C-N-CA 123.967 0.907 . . . . 0.0 111.582 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.2 ttm . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.724 0.297 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.99 -69.2 0.66 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.546 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -125.58 -90.18 0.55 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.748 0.308 . . . . 0.0 111.699 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -112.06 165.33 12.08 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.41 -178.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -119.12 141.76 48.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.92 0.391 . . . . 0.0 111.299 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -93.12 -48.64 6.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.92 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 64.56 -176.21 0.17 Allowed 'General case' 0 N--CA 1.468 0.458 0 O-C-N 123.737 0.648 . . . . 0.0 111.938 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.8 p -127.36 145.01 52.83 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.059 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.66 132.61 41.12 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.801 2.334 . . . . 0.0 111.998 176.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 98.4 mt -73.29 107.7 5.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.435 -178.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -160.44 108.1 1.6 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.661 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -84.86 141.58 38.27 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.154 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -56.66 115.57 2.57 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.998 2.465 . . . . 0.0 112.34 -177.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.73 1.32 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.833 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.88 12.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.38 -36.22 3.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.984 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.74 91.89 2.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.894 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.89 -54.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.838 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.85 111.21 13.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.973 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.02 125.58 24.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.755 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.76 19.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.009 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.544 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.9 m95 -141.97 53.02 1.48 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.782 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.23 -156.57 0.13 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.879 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.478 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.27 -37.72 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.87 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.76 122.69 47.17 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.593 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.33 168.18 16.64 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 124.03 0.831 . . . . 0.0 110.399 176.135 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.7 tpt 74.35 -24.08 0.22 Allowed 'General case' 0 N--CA 1.473 0.708 0 O-C-N 123.736 0.648 . . . . 0.0 112.268 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -145.93 -173.08 4.06 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.671 0.272 . . . . 0.0 110.898 -178.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -78.46 143.6 36.54 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.601 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -66.11 109.03 2.44 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.609 -177.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.8 t -157.61 -27.63 0.08 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.735 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 22.0 t -85.53 103.82 12.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.297 177.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.451 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 1.0 OUTLIER -102.5 117.79 60.16 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -173.784 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 33' ' ' ILE . 4.7 Cg_exo -77.63 118.52 4.56 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.111 2.541 . . . . 0.0 111.489 173.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -112.57 88.71 0.5 Allowed Glycine 0 CA--C 1.517 0.215 0 C-N-CA 120.464 -0.874 . . . . 0.0 113.15 -176.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.42 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 13.5 tpt -163.12 121.86 1.32 Allowed Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 116.518 0.159 . . . . 0.0 110.836 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 36' ' ' MET . 30.2 Cg_exo -62.58 149.02 92.45 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.858 2.372 . . . . 0.0 112.277 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.596 ' HB ' ' HA ' ' B' ' 460' ' ' VAL . 52.6 p -107.89 -26.22 10.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.661 -175.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' B' ' 461' ' ' THR . 32.9 m -55.73 139.43 14.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.004 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.797 ' H ' ' HG3' ' B' ' 462' ' ' LYS . 0.1 OUTLIER -99.11 133.26 22.28 Favored Pre-proline 0 CA--C 1.533 0.307 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.36 -178.05 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' A' ' 40' ' ' ILE . 14.8 Cg_exo -68.65 152.05 74.63 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 123.586 2.857 . . . . 0.0 112.847 -176.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -80.47 105.58 1.75 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.652 2.234 . . . . 0.0 112.803 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 137.36 41.34 0.1 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.262 177.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -127.86 -170.64 2.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.219 0.533 . . . . 0.0 111.475 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.464 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 71.5 p -119.1 162.3 18.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.159 176.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.526 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.72 -31.42 72.34 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 120.896 0.379 . . . . 0.0 111.334 -178.239 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.464 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.3 -45.21 61.01 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.08 -33.45 73.55 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.749 -177.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.711 ' HG3' HD13 ' A' ' 40' ' ' ILE . 39.6 tt0 -59.22 -46.32 88.77 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.998 177.448 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.554 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.18 -43.36 98.44 Favored 'General case' 0 C--O 1.185 -2.316 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.229 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.545 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.39 -41.41 84.81 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.765 0.666 . . . . 0.0 111.602 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -66.99 -42.79 84.44 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.024 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.691 HG23 HG21 ' B' ' 460' ' ' VAL . 96.6 mt -66.25 -49.14 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.768 177.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -65.57 -35.65 75.75 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.931 -176.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.11 -44.39 91.99 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.491 0.587 . . . . 0.0 110.372 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.3 tp -62.67 -42.01 99.39 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.807 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.527 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 40.1 mt-30 -68.78 -35.67 77.34 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.641 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.485 HD13 HD13 ' A' ' 113' ' ' ILE . 73.3 mt -62.83 -47.0 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.431 178.48 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.35 -41.81 84.52 Favored 'General case' 0 CA--C 1.513 -0.47 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.701 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.26 -33.15 73.83 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.441 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.1 -44.94 78.72 Favored 'General case' 0 C--O 1.207 -1.159 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 173.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.0 m -65.55 -35.79 81.88 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.72 -42.83 75.89 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 122.089 0.947 . . . . 0.0 108.531 176.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.2 ttmt -61.75 -47.75 83.8 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 113.773 -1.558 . . . . 0.0 111.921 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.17 -28.89 63.51 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.788 -0.765 . . . . 0.0 111.863 177.01 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.95 -47.16 69.41 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.1 -17.52 14.46 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.966 -0.694 . . . . 0.0 112.853 -177.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.45 10.76 Favored Glycine 0 C--N 1.316 -0.53 0 C-N-CA 119.857 -1.163 . . . . 0.0 111.268 -177.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.43 91.37 6.84 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.233 0.539 . . . . 0.0 110.171 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.4 tp -101.8 -51.68 3.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 178.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.15 -94.19 1.67 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.486 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.416 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 25.2 pt -104.15 144.67 29.17 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.568 0.223 . . . . 0.0 110.953 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 72' ' ' ILE . 16.0 Cg_exo -68.46 146.35 67.98 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.693 2.262 . . . . 0.0 112.069 178.066 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.59 -45.57 32.92 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.863 2.375 . . . . 0.0 111.958 178.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.43 ' HA ' ' HD2' ' A' ' 76' ' ' PRO . 5.5 m-20 -123.9 96.61 42.45 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.646 176.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 75' ' ' ASN . 21.0 Cg_endo -60.82 -54.54 1.88 Allowed 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.822 2.348 . . . . 0.0 111.802 176.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -104.66 102.81 12.39 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.455 173.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -66.28 146.6 54.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.325 0.584 . . . . 0.0 111.455 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 79' ' ' ARG . 62.3 mtt-85 -81.43 -157.28 0.17 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.584 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 42.2 t -65.4 128.5 93.85 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.181 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.66 129.35 31.98 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.977 2.451 . . . . 0.0 112.777 -177.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.518 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 36.0 t -143.48 136.72 13.97 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.884 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.518 ' HD3' ' HA ' ' A' ' 82' ' ' SER . 7.0 Cg_exo -73.46 -177.62 3.16 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 123.121 2.547 . . . . 0.0 113.055 -179.51 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 85' ' ' PRO . 8.4 pt-20 -89.12 141.4 29.29 Favored Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.497 -178.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 84' ' ' GLU . 11.6 Cg_exo -70.9 -30.75 16.52 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.208 2.606 . . . . 0.0 112.075 176.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 6.2 tp -80.15 137.78 20.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.867 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -85.87 117.53 24.79 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.842 178.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -118.81 129.76 55.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.948 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.9 m -72.54 -52.08 17.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.622 -176.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -160.58 151.99 19.38 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.101 0.477 . . . . 0.0 111.375 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -118.79 179.2 16.83 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.419 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 95' ' ' ASN . 33.6 mmtp -86.01 155.15 20.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.676 0.275 . . . . 0.0 110.807 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.8 tpp180 -89.13 -28.56 19.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.49 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.93 -34.87 17.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.65 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.472 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 65.8 t30 -117.94 120.66 38.53 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.089 -177.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -163.01 -50.15 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.772 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.1 -52.58 16.12 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.257 -0.902 . . . . 0.0 109.661 -178.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.466 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.5 mp0 -53.23 -51.77 61.1 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.623 -1.626 . . . . 0.0 110.667 -178.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -66.68 -38.68 87.29 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 113.466 -1.697 . . . . 0.0 110.659 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.535 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.9 -44.54 94.19 Favored 'General case' 0 CA--C 1.511 -0.538 0 O-C-N 123.22 0.325 . . . . 0.0 110.402 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.722 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.4 m -68.95 -50.07 52.42 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.703 178.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.455 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.34 -41.37 93.99 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.99 -39.15 90.08 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 100' ' ' ARG . 6.2 tmtt? -60.19 -40.11 88.9 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.98 -41.05 97.64 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.657 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.02 -34.33 78.18 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.824 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.37 74.3 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 177.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.43 -48.86 76.03 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 175.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.552 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.29 -45.53 94.09 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.405 179.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.21 -37.42 85.28 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.564 0.746 . . . . 0.0 111.044 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.84 -43.75 86.07 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.433 HD13 ' HB2' ' A' ' 57' ' ' GLN . 65.6 mt -72.22 -38.58 68.96 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.768 177.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.47 -50.87 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 110.489 -0.189 . . . . 0.0 110.489 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.7 m -60.68 -39.5 88.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.277 0.561 . . . . 0.0 110.557 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.612 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.94 -49.6 60.86 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.005 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.37 -37.12 84.57 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.8 t -65.53 -36.81 78.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.17 0.509 . . . . 0.0 109.644 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.73 80.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.23 0.538 . . . . 0.0 110.25 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.6 mt -71.45 -40.61 70.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.023 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.63 111.2 12.47 Favored Pre-proline 0 C--N 1.317 -0.826 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.936 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.74 -22.66 36.88 Favored 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 122.8 2.334 . . . . 0.0 112.57 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.34 0.13 55.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.101 -177.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.97 134.68 54.44 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.616 -178.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.41 109.11 62.83 Favored Pre-proline 0 CA--C 1.509 -0.614 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.274 177.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.24 157.89 59.85 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 122.303 2.002 . . . . 0.0 111.485 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.55 154.51 24.73 Favored 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 123.603 2.868 . . . . 0.0 111.777 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.06 -32.41 72.74 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 -173.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -73.82 -24.92 59.86 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 123.895 0.747 . . . . 0.0 110.951 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -68.85 122.93 19.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.295 175.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -111.57 139.49 22.15 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.772 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.462 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 30.9 Cg_endo -64.51 136.2 49.34 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.548 2.165 . . . . 0.0 111.612 175.01 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 31.5 Cg_exo -60.34 169.21 5.39 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.041 2.494 . . . . 0.0 112.99 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . 70.07 113.32 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.659 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 64.9 p -78.45 -25.86 46.01 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.41 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 21.2 mmm180 70.44 160.2 0.21 Allowed 'General case' 0 N--CA 1.472 0.653 0 O-C-N 123.764 0.665 . . . . 0.0 112.181 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 16.8 m -114.54 169.76 5.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.338 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 85.6 m 65.52 -173.08 0.18 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.788 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -122.54 123.66 41.75 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.073 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.448 ' HB3' ' H ' ' A' ' 140' ' ' VAL . 9.2 mmmm 63.53 -163.04 0.27 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.75 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.448 ' H ' ' HB3' ' A' ' 139' ' ' LYS . 2.2 t -107.14 148.12 11.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.075 -177.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' MET . . . . . 0.415 ' HG2' ' H ' ' A' ' 141' ' ' MET . 4.6 ptt? -87.13 172.11 10.19 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.603 176.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 5.0 mt -112.12 116.33 49.33 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.778 -175.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -76.08 131.82 13.44 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.4 2.067 . . . . 0.0 111.804 173.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -103.56 149.66 24.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.103 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 26.4 t70 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.169 -0.92 . . . . 0.0 110.642 179.774 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 112.421 -0.272 . . . . 0.0 112.421 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 373' ' ' HIS . . . . . 0.611 ' H ' ' HD2' ' B' ' 374' ' ' PRO . 24.7 t60 -129.85 -47.19 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.484 0 CA-C-O 119.177 -0.44 . . . . 0.0 111.966 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 374' ' ' PRO . . . . . 0.611 ' HD2' ' H ' ' B' ' 373' ' ' HIS . 80.8 Cg_exo -50.62 129.04 25.59 Favored 'Trans proline' 0 C--N 1.364 1.356 0 C-N-CA 122.363 2.042 . . . . 0.0 113.358 178.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 375' ' ' THR . . . . . 0.462 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -117.77 -71.38 0.74 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.119 179.892 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 376' ' ' GLU . . . . . 0.495 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.91 0.01 OUTLIER 'General case' 0 C--O 1.232 0.136 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 377' ' ' VAL . . . . . 0.565 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.66 150.97 7.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.431 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 378' ' ' LEU . . . . . 0.483 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.59 152.51 20.86 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.246 -179.086 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 379' ' ' CYS . . . . . 0.59 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.55 142.61 46.49 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.567 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.513 HD11 HG13 ' B' ' 434' ' ' VAL . 5.4 mt -132.79 103.13 5.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.968 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 10.3 ttt -116.86 162.79 17.17 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.194 -176.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.58 51.25 8.09 Favored 'General case' 0 C--N 1.342 0.262 0 O-C-N 123.208 0.318 . . . . 0.0 111.275 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 383' ' ' MET . . . . . 0.433 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.92 14.39 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.259 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 384' ' ' VAL . . . . . 0.707 HG21 HG23 ' B' ' 432' ' ' ILE . 0.4 OUTLIER -152.3 125.11 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.83 0.347 . . . . 0.0 111.354 179.863 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.69 151.77 43.04 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.428 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.12 -23.53 73.29 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.307 2.005 . . . . 0.0 112.315 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.85 -5.48 53.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.559 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.07 -36.7 5.78 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.901 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 389' ' ' LEU . . . . . 0.474 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.91 0.46 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 390' ' ' LEU . . . . . 0.55 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.53 -15.73 5.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.663 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -98.28 148.77 23.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.574 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -73.52 -30.26 62.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.21 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -75.37 -47.65 26.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.728 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.57 -44.27 91.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.768 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -56.4 -59.34 5.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.249 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.3 61.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.194 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.1 -41.04 67.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.412 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 398' ' ' ILE . . . . . 0.498 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.89 -53.67 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.517 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 399' ' ' VAL . . . . . 0.611 HG22 HD12 ' B' ' 417' ' ' ILE . 59.6 t -53.34 -46.91 58.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.814 -179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.99 3.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.486 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.63 -57.13 11.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.389 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.15 -32.9 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.33 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 403' ' ' ARG . . . . . 0.451 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.2 -57.41 4.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.706 0.288 . . . . 0.0 111.116 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.98 -33.57 64.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.162 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 405' ' ' GLU . . . . . 0.544 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.5 -47.04 44.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.942 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.89 -23.88 67.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.144 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.12 30.38 1.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.961 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.13 -17.17 12.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.863 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.41 14.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.574 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.14 -139.4 4.14 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.586 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.22 132.4 56.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.678 0.275 . . . . 0.0 111.101 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 412' ' ' VAL . . . . . 0.424 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.36 115.43 48.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.01 0.433 . . . . 0.0 110.692 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 413' ' ' LYS . . . . . 0.68 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.63 -61.95 2.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.186 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.02 -169.4 3.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.088 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 415' ' ' ILE . . . . . 0.611 HG23 HG12 ' B' ' 434' ' ' VAL . 48.7 mt -145.12 128.98 12.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.833 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 416' ' ' GLU . . . . . 0.43 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.87 108.8 18.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.667 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 417' ' ' ILE . . . . . 0.955 HG23 HG21 ' B' ' 432' ' ' ILE . 60.9 mt -128.56 108.6 18.99 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.625 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 418' ' ' PRO . . . . . 0.634 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.6 Cg_endo -48.56 147.65 9.11 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.667 2.245 . . . . 0.0 112.866 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 419' ' ' ARG . . . . . 0.55 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.93 74.73 21.73 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.149 179.854 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -47.15 117.05 2.0 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.728 2.285 . . . . 0.0 112.491 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 421' ' ' VAL . . . . . 0.598 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.2 t -74.36 97.77 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.186 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.65 21.77 9.14 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.479 0.657 . . . . 0.0 109.32 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 423' ' ' GLY . . . . . 0.617 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.26 29.26 6.1 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.328 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 424' ' ' VAL . . . . . 0.598 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.51 -37.45 30.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.94 35.9 4.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 111.776 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 426' ' ' VAL . . . . . 0.678 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.33 -44.74 48.12 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.783 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 427' ' ' PRO . . . . . 0.678 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.29 77.08 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.497 2.131 . . . . 0.0 111.095 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.3 -15.39 3.22 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.359 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.3 t -67.54 149.38 50.22 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.573 0.225 . . . . 0.0 110.82 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.51 -14.2 5.06 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.814 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.43 126.13 44.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.871 0.367 . . . . 0.0 111.092 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 432' ' ' ILE . . . . . 0.955 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -131.05 172.87 15.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.232 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 433' ' ' PHE . . . . . 0.59 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.33 2.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.958 0.409 . . . . 0.0 112.015 -178.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 434' ' ' VAL . . . . . 0.611 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.86 141.68 41.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.18 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 435' ' ' GLU . . . . . 0.492 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.31 108.48 17.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.841 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.7 168.42 12.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.234 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 437' ' ' THR . . . . . 0.68 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -95.02 -45.34 7.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.439 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.94 146.62 52.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 111.198 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.26 -12.7 16.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.248 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.9 24.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.098 0.475 . . . . 0.0 110.078 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -75.07 -29.52 60.71 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.842 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.16 -31.74 72.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.209 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -78.72 -47.99 15.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.622 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.1 59.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.709 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.79 -55.76 3.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 446' ' ' MET . . . . . 0.468 ' HB3' HD21 ' B' ' 378' ' ' LEU . 4.2 ptm -63.64 -27.7 69.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.297 -179.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.51 -16.26 63.41 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.632 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.65 -8.58 22.52 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.374 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 449' ' ' LEU . . . . . 0.401 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.71 -19.02 20.02 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.813 0.34 . . . . 0.0 110.969 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 3.6 t -74.37 131.1 40.82 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.989 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.53 -9.65 73.73 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.23 178.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 452' ' ' ARG . . . . . 0.431 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -76.41 -152.23 0.04 OUTLIER 'General case' 0 C--N 1.339 0.133 0 CA-C-N 117.327 0.564 . . . . 0.0 110.495 178.495 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 453' ' ' LYS . . . . . 0.478 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.79 117.12 2.29 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.811 0.338 . . . . 0.0 111.292 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.2 -36.4 75.29 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.545 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.824 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -157.29 24.93 0.3 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.771 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 457' ' ' ARG . . . . . 0.426 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.5 135.3 18.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.279 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 46.3 t -63.38 122.44 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.42 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 59.4 t -76.62 121.28 28.49 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.714 -177.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 460' ' ' VAL . . . . . 0.691 HG21 HG23 ' A' ' 53' ' ' ILE . 65.5 t -89.79 96.94 6.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.364 176.015 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 461' ' ' THR . . . . . 0.464 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 10.3 t -91.04 153.54 20.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.661 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 462' ' ' LYS . . . . . 0.797 ' HG3' ' H ' ' A' ' 40' ' ' ILE . 2.0 ttpp -159.18 -167.52 2.09 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 121.106 0.479 . . . . 0.0 110.76 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -114.21 146.99 39.65 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 123.385 0.674 . . . . 0.0 110.452 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 464' ' ' CYS . . . . . 0.565 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.91 149.02 47.36 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.104 0.478 . . . . 0.0 111.286 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 465' ' ' ASP . . . . . 0.462 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.39 129.34 66.67 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.372 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 466' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.04 -33.32 72.84 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.75 2.3 . . . . 0.0 112.097 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.97 -58.52 7.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.441 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.36 -33.78 68.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.336 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 469' ' ' TYR . . . . . 0.492 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.0 -51.27 70.39 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.21 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.36 -47.51 69.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.367 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 471' ' ' ARG . . . . . 0.442 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.13 49.35 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.44 -179.925 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.73 8.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.942 0.401 . . . . 0.0 110.269 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 473' ' ' ASP . . . . . 0.442 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.81 -20.54 23.17 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.006 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 63.0 48.39 3.87 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 122.92 0.488 . . . . 0.0 112.017 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 50.7 m95 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.519 -0.753 . . . . 0.0 111.38 179.648 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.3 mtt . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 120.836 0.351 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.77 128.37 34.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.25 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 8.0 t -86.61 -17.5 33.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.67 177.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -179.04 165.85 35.04 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.946 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.28 76.11 8.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.08 0.467 . . . . 0.0 110.974 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -110.46 -38.16 5.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.742 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.73 -46.41 68.96 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.467 177.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.4 p -96.94 119.53 63.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.27 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.49 127.12 21.79 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.729 2.286 . . . . 0.0 112.93 -177.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 mm? 60.0 -98.82 0.09 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.426 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -128.02 -158.47 0.88 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.924 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.414 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 67.3 m-85 -68.77 140.48 91.74 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.235 177.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 38.8 Cg_exo -56.38 115.48 2.5 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 123.1 2.533 . . . . 0.0 112.458 -174.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.71 1.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.846 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.38 51.93 12.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.913 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.37 -36.24 3.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.992 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.71 91.86 2.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.86 -54.26 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.83 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.79 111.2 13.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.039 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.05 125.6 25.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.693 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 21' ' ' ARG . 0.9 OUTLIER -112.58 12.75 19.92 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.01 -179.805 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.554 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.9 m95 -141.98 53.11 1.48 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.731 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -156.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.84 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.477 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.37 -37.6 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.91 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.65 113.49 24.41 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.246 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.837 HG23 ' H ' ' A' ' 27' ' ' MET . 1.8 t 174.7 -93.38 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -175.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.837 ' H ' HG23 ' A' ' 26' ' ' THR . 3.0 mtm -68.66 -46.74 68.31 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 120.653 0.263 . . . . 0.0 110.325 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 64.82 93.04 0.07 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.377 175.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -133.66 -69.51 0.54 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.133 176.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.425 ' HE2' ' NE2' ' A' ' 57' ' ' GLN . 47.4 mtpt -101.27 91.49 4.53 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 175.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.2 p -89.41 154.53 19.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.932 -0.577 . . . . 0.0 112.55 -173.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.866 HG11 ' HA2' ' B' ' 451' ' ' GLY . 4.9 p -128.73 145.51 35.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.953 170.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.447 HG12 ' HD2' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -95.07 130.32 33.0 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 177.315 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.447 ' HD2' HG12 ' A' ' 33' ' ' ILE . 11.2 Cg_endo -55.07 118.96 5.74 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.056 2.504 . . . . 0.0 112.742 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.82 -27.75 4.55 Favored Glycine 0 N--CA 1.453 -0.216 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.976 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 25.0 mmt -99.48 123.24 48.9 Favored Pre-proline 0 C--N 1.332 -0.188 0 CA-C-O 120.653 0.263 . . . . 0.0 110.554 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.592 ' HB2' HG22 ' A' ' 39' ' ' VAL . 60.5 Cg_endo -72.93 156.23 52.56 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.705 2.27 . . . . 0.0 113.231 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . 1.045 ' HB ' HG12 ' B' ' 460' ' ' VAL . 34.9 p -115.42 9.24 15.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.38 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.592 HG22 ' HB2' ' A' ' 37' ' ' PRO . 15.4 m -69.91 136.3 26.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.131 179.242 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 1.019 ' HB ' ' HD2' ' B' ' 462' ' ' LYS . 57.1 mt -105.12 119.61 52.54 Favored Pre-proline 0 C--N 1.331 -0.211 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 178.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.465 ' HA ' ' HD3' ' A' ' 42' ' ' PRO . 12.4 Cg_endo -55.06 156.3 16.41 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.311 2.674 . . . . 0.0 113.025 -178.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 6.9 Cg_endo -82.31 107.84 1.69 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.949 2.433 . . . . 0.0 112.591 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 135.71 29.95 0.35 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.795 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -111.19 139.17 46.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.655 0.264 . . . . 0.0 111.593 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 48.5 p -77.56 157.92 30.1 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 173.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.613 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -63.36 -31.32 72.44 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 120.856 0.36 . . . . 0.0 111.319 -173.511 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -72.38 -45.04 61.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.3 -32.83 72.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.735 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.613 ' HG2' ' O ' ' A' ' 46' ' ' ARG . 20.2 pt-20 -66.84 -38.3 86.13 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.028 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.559 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.99 -43.34 96.01 Favored 'General case' 0 C--O 1.185 -2.338 0 CA-C-O 118.877 -0.583 . . . . 0.0 110.25 174.443 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.537 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.43 -41.95 86.21 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 123.794 0.684 . . . . 0.0 111.597 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -64.21 -48.12 77.08 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.834 175.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.699 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 63.5 mt -60.61 -51.8 68.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 120.872 0.368 . . . . 0.0 110.802 177.178 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.559 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -64.77 -35.62 75.48 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.789 0 CA-C-O 118.67 -0.681 . . . . 0.0 111.919 -174.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.01 -44.31 91.66 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.566 0.621 . . . . 0.0 110.317 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 2.2 pp -71.35 -28.19 63.89 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.884 179.298 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.619 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 14.2 mm-40 -74.51 -36.25 63.22 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 174.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.48 HD13 HD13 ' A' ' 113' ' ' ILE . 72.9 mt -63.21 -46.97 94.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.404 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.49 -40.86 85.22 Favored 'General case' 0 CA--C 1.513 -0.476 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.7 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.496 ' OD2' ' HA ' ' A' ' 32' ' ' VAL . 84.5 m-20 -71.67 -30.25 65.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.321 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.542 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.51 -44.93 77.22 Favored 'General case' 0 C--O 1.208 -1.131 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 171.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.62 -35.79 81.82 Favored 'General case' 0 N--CA 1.432 -1.343 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.5 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.84 -42.7 76.16 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 176.163 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.542 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.81 -47.82 83.38 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 113.856 -1.52 . . . . 0.0 111.848 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.416 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.12 -28.91 63.58 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.883 177.024 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -67.98 -47.14 69.38 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.5 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.1 -17.49 14.47 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.916 0.709 . . . . 0.0 112.916 -177.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.47 10.73 Favored Glycine 0 C--N 1.316 -0.565 0 C-N-CA 119.884 -1.151 . . . . 0.0 111.29 -177.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.39 91.42 6.83 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.229 0.538 . . . . 0.0 110.24 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.85 12.84 17.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.626 177.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 142.29 -6.77 2.26 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.031 -177.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.459 ' HB ' ' HD2' ' A' ' 73' ' ' PRO . 39.1 pt -98.08 160.38 28.5 Favored Pre-proline 0 C--N 1.331 -0.221 0 C-N-CA 122.169 0.188 . . . . 0.0 110.939 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.459 ' HD2' ' HB ' ' A' ' 72' ' ' ILE . 24.2 Cg_endo -63.38 131.56 32.48 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.627 2.218 . . . . 0.0 112.358 177.163 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.78 141.37 96.69 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.27 2.647 . . . . 0.0 112.899 -178.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.8 m120 58.65 71.38 1.0 Allowed Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.148 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -81.59 -15.25 9.86 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.413 2.075 . . . . 0.0 112.15 176.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.61 170.92 15.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.695 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -160.11 -44.03 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.93 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -94.58 96.67 9.6 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.887 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.5 m -150.14 107.35 3.19 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.223 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -72.37 133.86 21.65 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.866 2.377 . . . . 0.0 111.932 176.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.411 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 66.6 p -115.0 115.14 43.42 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.874 0.369 . . . . 0.0 111.842 -177.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 82' ' ' SER . 5.0 Cg_exo -75.72 134.09 16.26 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.174 2.583 . . . . 0.0 111.968 176.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -130.75 106.21 15.48 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-O 120.843 0.354 . . . . 0.0 111.361 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -79.75 117.28 3.61 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.984 2.456 . . . . 0.0 111.374 174.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.9 mm -73.98 134.95 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.713 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 27.7 t80 69.12 92.73 0.08 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.906 0.754 . . . . 0.0 110.756 -177.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -80.59 110.5 16.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.392 -177.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 42.9 t -74.78 -31.43 61.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.818 177.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -99.48 107.2 19.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.659 178.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -96.83 83.76 0.78 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.234 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 50.0 pttt -141.31 152.51 44.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.815 0.34 . . . . 0.0 111.257 -176.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -95.77 -57.43 2.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.939 -179.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 55.7 mt 74.94 -15.14 0.68 Allowed 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 174.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -84.52 131.76 34.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.166 0.508 . . . . 0.0 111.65 -175.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -122.42 -50.23 2.0 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.711 173.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.1 -52.5 16.47 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.226 -0.922 . . . . 0.0 109.659 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.461 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.4 mp0 -53.32 -51.7 61.55 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 113.677 -1.602 . . . . 0.0 110.659 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -66.73 -38.63 87.05 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.498 -1.683 . . . . 0.0 110.678 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.95 -44.55 94.33 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.177 0.298 . . . . 0.0 110.307 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.704 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.8 m -69.01 -49.99 52.77 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.691 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.454 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.43 -41.28 93.7 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -175.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.0 -39.07 89.98 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.533 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.29 -40.14 89.41 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.91 -41.01 97.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.736 178.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.11 -34.35 78.19 Favored 'General case' 0 C--O 1.21 -1.009 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.712 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.44 -34.34 74.27 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 177.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.54 -48.75 76.24 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 175.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.552 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.35 -45.51 94.08 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.392 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.27 -37.37 85.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.017 -178.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.91 -43.7 86.34 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 177.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.488 HD13 ' HB2' ' A' ' 57' ' ' GLN . 65.4 mt -72.28 -38.53 68.77 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.75 177.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.38 -50.85 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 120.514 0.197 . . . . 0.0 110.544 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 96.2 m -60.81 -39.46 89.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.148 0.499 . . . . 0.0 110.477 -179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.611 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.57 60.93 Favored 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.03 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.32 -37.08 84.56 Favored 'General case' 0 C--O 1.217 -0.621 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.0 t -65.59 -36.88 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.59 -40.76 80.35 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.162 0.505 . . . . 0.0 110.211 177.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 67.0 mt -71.49 -40.61 70.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.995 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ASN . . . . . 0.405 ' HA ' ' HD2' ' A' ' 121' ' ' PRO . 45.5 t30 -133.56 111.14 12.54 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.001 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 120' ' ' ASN . 59.7 Cg_endo -68.72 -22.69 36.94 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 122.805 2.337 . . . . 0.0 112.56 -178.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.33 0.14 55.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.336 0.589 . . . . 0.0 111.121 -177.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.96 134.61 54.31 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.651 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.32 109.16 62.89 Favored Pre-proline 0 N--CA 1.446 -0.642 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.332 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.28 157.98 59.49 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.228 1.952 . . . . 0.0 111.473 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.66 154.47 25.47 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 123.598 2.865 . . . . 0.0 111.737 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.06 -30.25 69.4 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -173.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -73.59 -25.27 60.26 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.851 0.719 . . . . 0.0 111.791 -174.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -72.58 131.14 42.08 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.723 0.297 . . . . 0.0 110.39 177.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 7.6 pttm -141.46 130.02 12.27 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.254 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.441 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 4.5 Cg_exo -74.56 140.0 26.23 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.813 2.342 . . . . 0.0 111.593 175.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 20.8 Cg_exo -64.88 100.26 0.35 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.176 2.584 . . . . 0.0 113.071 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -138.84 -44.22 0.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.046 178.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 7.3 t -132.78 -18.72 2.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.365 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.9 ttm180 61.21 95.88 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.854 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 18.3 t -101.46 89.46 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.622 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 8.5 p -133.82 113.86 12.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.428 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -127.43 -27.15 2.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.457 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.428 ' HD2' ' HA ' ' A' ' 139' ' ' LYS . 20.8 tptm -89.11 108.09 19.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.08 0.467 . . . . 0.0 110.845 -179.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.5 p -148.67 148.61 15.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.294 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 45.7 ttm -70.85 126.11 28.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.996 0.427 . . . . 0.0 111.366 -179.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 3.0 mt -97.96 106.08 31.99 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.81 175.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -68.05 153.63 74.55 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.972 2.448 . . . . 0.0 112.996 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -91.47 119.6 31.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.358 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.396 -0.811 . . . . 0.0 110.832 -178.244 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.544 -0.222 . . . . 0.0 112.544 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 373' ' ' HIS . . . . . 0.703 ' HB3' ' HD3' ' B' ' 374' ' ' PRO . 14.0 t-80 -92.67 -54.54 0.25 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 119.647 -0.216 . . . . 0.0 111.562 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 374' ' ' PRO . . . . . 0.703 ' HD3' ' HB3' ' B' ' 373' ' ' HIS . 13.3 Cg_exo -70.7 149.53 61.02 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.288 1.992 . . . . 0.0 113.586 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 375' ' ' THR . . . . . 0.463 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -129.01 -71.32 0.64 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.121 176.883 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 376' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.88 -45.92 0.01 OUTLIER 'General case' 0 C--O 1.232 0.172 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 377' ' ' VAL . . . . . 0.565 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.72 151.02 7.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.423 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 378' ' ' LEU . . . . . 0.472 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.7 152.57 20.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.207 -179.014 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 379' ' ' CYS . . . . . 0.602 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.7 t -115.56 142.61 46.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.641 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.51 HD11 HG13 ' B' ' 434' ' ' VAL . 5.4 mt -132.73 101.49 5.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.979 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 67.2 mtt -116.95 165.7 13.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.911 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.38 51.16 8.53 Favored 'General case' 0 CA--C 1.529 0.152 0 O-C-N 123.609 0.568 . . . . 0.0 111.324 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 383' ' ' MET . . . . . 0.442 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.87 14.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.235 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 384' ' ' VAL . . . . . 0.745 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.36 125.08 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.349 . . . . 0.0 111.369 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.415 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.69 151.72 43.01 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.412 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.1 -23.44 73.42 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.306 2.004 . . . . 0.0 112.342 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.93 -5.47 53.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.504 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.04 -36.8 5.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 389' ' ' LEU . . . . . 0.471 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.96 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.55 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 390' ' ' LEU . . . . . 0.557 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.54 -15.74 5.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.676 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -98.33 148.76 23.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.555 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -73.56 -30.26 62.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.218 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.39 -47.58 26.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.794 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.54 -44.27 91.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.795 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.43 -59.33 5.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -27.33 61.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.08 -41.09 67.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.418 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 398' ' ' ILE . . . . . 0.497 HD13 HG12 ' B' ' 384' ' ' VAL . 65.6 mt -74.86 -53.74 15.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.491 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 399' ' ' VAL . . . . . 0.622 HG22 HD12 ' B' ' 417' ' ' ILE . 59.8 t -53.28 -46.91 57.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.85 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.43 -59.99 3.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.5 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.65 -57.19 11.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.39 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.12 -32.85 15.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.333 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 403' ' ' ARG . . . . . 0.459 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.2 -57.43 4.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 111.141 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.94 -33.61 64.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.205 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 405' ' ' GLU . . . . . 0.554 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.44 -47.08 44.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.001 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.78 -24.04 67.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.137 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.33 1.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.97 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.04 -17.17 12.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -106.68 -15.38 14.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.594 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.15 -139.46 4.17 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.616 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 411' ' ' LEU . . . . . 0.417 ' HA ' HD13 ' B' ' 411' ' ' LEU . 1.6 mm? -114.21 132.5 56.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.645 0.259 . . . . 0.0 111.11 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 412' ' ' VAL . . . . . 0.423 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.41 115.37 48.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.007 0.432 . . . . 0.0 110.631 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 413' ' ' LYS . . . . . 0.703 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.59 -62.0 2.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.225 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.95 -169.35 3.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.109 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 415' ' ' ILE . . . . . 0.616 HG23 HG12 ' B' ' 434' ' ' VAL . 48.7 mt -145.13 128.99 12.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.842 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 416' ' ' GLU . . . . . 0.423 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.8 108.76 18.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.712 179.791 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 417' ' ' ILE . . . . . 1.018 HG23 HG21 ' B' ' 432' ' ' ILE . 60.7 mt -128.56 108.53 18.98 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.725 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 418' ' ' PRO . . . . . 0.631 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.45 147.61 8.85 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.664 2.243 . . . . 0.0 112.965 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 419' ' ' ARG . . . . . 0.557 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.9 74.72 21.88 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.145 179.891 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.2 117.15 2.08 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.749 2.3 . . . . 0.0 112.434 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 421' ' ' VAL . . . . . 0.599 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 95.9 t -74.44 97.82 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.171 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.59 21.77 9.05 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.596 0.713 . . . . 0.0 109.353 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 423' ' ' GLY . . . . . 0.649 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.27 29.28 6.09 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.232 -179.018 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 424' ' ' VAL . . . . . 0.599 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.48 -37.49 30.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.94 35.81 4.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.787 0.327 . . . . 0.0 111.774 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 426' ' ' VAL . . . . . 0.671 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.26 -44.75 48.97 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.827 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 427' ' ' PRO . . . . . 0.671 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.2 Cg_endo -66.32 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.443 2.095 . . . . 0.0 111.078 179.482 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.29 -15.4 3.22 Favored Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.306 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.59 149.34 50.22 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.582 0.23 . . . . 0.0 110.829 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.49 -14.16 5.07 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.879 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.42 126.2 44.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 110.979 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 432' ' ' ILE . . . . . 1.018 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.06 172.94 15.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.279 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 433' ' ' PHE . . . . . 0.602 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.51 -176.42 2.81 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.968 0.413 . . . . 0.0 111.994 -178.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 434' ' ' VAL . . . . . 0.616 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.76 141.76 41.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.165 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 435' ' ' GLU . . . . . 0.483 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.7 tt0 -84.35 108.48 17.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.811 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.74 168.37 12.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.239 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 437' ' ' THR . . . . . 0.703 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.5 p -94.96 -45.32 7.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.465 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.93 146.59 52.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.077 0.465 . . . . 0.0 111.165 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.17 -12.8 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.239 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -54.91 24.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.152 0.501 . . . . 0.0 110.083 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -75.1 -29.46 60.61 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.805 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -31.86 72.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.142 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -78.59 -47.94 16.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.703 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.7 -11.97 59.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.723 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -56.16 3.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.898 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 446' ' ' MET . . . . . 0.489 ' HE2' HG12 ' A' ' 39' ' ' VAL . 2.9 ptm -61.54 -29.71 70.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.285 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.23 -16.23 63.55 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.626 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.59 -8.63 22.57 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.443 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 449' ' ' LEU . . . . . 0.403 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.68 -19.78 19.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.806 0.336 . . . . 0.0 110.943 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 450' ' ' THR . . . . . 0.466 HG22 ' OG1' ' A' ' 38' ' ' THR . 21.8 p -70.71 130.06 40.76 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.992 175.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 451' ' ' GLY . . . . . 0.866 ' HA2' HG11 ' A' ' 32' ' ' VAL . . . 93.49 -8.9 74.59 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.578 177.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 452' ' ' ARG . . . . . 0.425 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.98 -152.2 0.05 Allowed 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 117.206 0.503 . . . . 0.0 110.531 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 453' ' ' LYS . . . . . 0.477 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.11 2.29 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.858 0.361 . . . . 0.0 111.326 -179.902 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.3 -36.34 75.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.551 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.25 -50.96 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.82 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 456' ' ' ASN . . . . . 0.773 ' HB3' ' HE3' ' A' ' 27' ' ' MET . 6.3 p30 -157.2 24.94 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.753 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 457' ' ' ARG . . . . . 0.442 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.47 133.04 16.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.309 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 458' ' ' VAL . . . . . 0.416 HG21 ' HB ' ' A' ' 32' ' ' VAL . 7.1 p -64.42 135.92 27.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 O-C-N 121.656 -0.652 . . . . 0.0 111.183 -177.311 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 459' ' ' VAL . . . . . 0.459 HG12 HG23 ' B' ' 461' ' ' THR . 45.1 t -91.1 121.55 41.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.167 -176.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 460' ' ' VAL . . . . . 1.045 HG12 ' HB ' ' A' ' 38' ' ' THR . 4.7 m -94.35 98.09 7.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.507 0.67 . . . . 0.0 110.488 176.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 461' ' ' THR . . . . . 0.459 HG23 HG12 ' B' ' 459' ' ' VAL . 17.0 p -97.53 128.88 44.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.122 -177.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 462' ' ' LYS . . . . . 1.019 ' HD2' ' HB ' ' A' ' 40' ' ' ILE . 5.8 ptmt -130.14 -160.5 1.04 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.742 -178.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 463' ' ' TYR . . . . . 0.426 ' H ' ' HB2' ' B' ' 462' ' ' LYS . 1.2 m-85 -114.96 147.01 40.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.59 -175.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 464' ' ' CYS . . . . . 0.565 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.92 148.98 47.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.15 0.5 . . . . 0.0 111.33 -179.901 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 465' ' ' ASP . . . . . 0.463 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.39 129.42 66.33 Favored Pre-proline 0 CA--C 1.529 0.153 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.373 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 466' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.11 -33.23 73.19 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.704 2.269 . . . . 0.0 112.06 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.53 7.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.374 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 468' ' ' SER . . . . . 0.428 ' HB3' ' HB3' ' B' ' 475' ' ' TRP . 0.8 OUTLIER -57.43 -33.77 68.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 469' ' ' TYR . . . . . 0.483 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.05 -51.21 70.61 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.221 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.31 -47.59 69.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.393 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 471' ' ' ARG . . . . . 0.45 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.65 -2.11 49.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.432 -179.915 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.01 20.86 8.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.924 0.393 . . . . 0.0 110.232 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 473' ' ' ASP . . . . . 0.45 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.88 -20.82 25.14 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.947 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 62.66 53.12 2.65 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.952 0.406 . . . . 0.0 111.078 -177.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 475' ' ' TRP . . . . . 0.428 ' HB3' ' HB3' ' B' ' 468' ' ' SER . 45.6 t-105 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.877 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.2 ttp . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.957 0.408 . . . . 0.0 110.532 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.66 -45.38 0.54 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.833 178.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.7 p 54.3 -164.89 0.1 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.715 0.806 . . . . 0.0 112.534 178.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 96.97 46.62 2.4 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.643 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 57.96 -109.27 0.46 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.822 0.449 . . . . 0.0 111.617 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 70.51 133.23 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.319 0.648 . . . . 0.0 112.175 178.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.5 161.62 19.3 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.116 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.0 m -108.95 108.49 60.7 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.835 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -81.08 146.8 16.19 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.765 2.31 . . . . 0.0 113.205 -178.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.454 HD23 ' HA ' ' A' ' 10' ' ' LEU . 6.9 mt -133.82 10.72 3.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.565 177.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -86.87 174.27 8.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.961 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -86.53 147.33 43.82 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.878 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.18 115.53 2.54 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.932 2.422 . . . . 0.0 112.32 177.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.02 -166.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.85 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.44 51.92 12.11 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.896 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.4 -36.21 3.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.927 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.72 91.85 2.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.96 -54.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.837 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.14 13.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.945 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.9 125.57 24.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.806 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 21' ' ' ARG . 0.9 OUTLIER -112.62 12.83 19.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.982 -179.763 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.549 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 72.0 m95 -142.02 53.1 1.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.756 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.28 -156.64 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.794 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.484 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.25 -37.73 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.852 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.71 120.58 40.56 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.534 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.6 p -136.8 169.13 18.25 Favored 'General case' 0 C--N 1.331 -0.239 0 O-C-N 124.007 0.817 . . . . 0.0 110.869 -178.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.525 ' HG3' ' HG2' ' A' ' 28' ' ' GLU . 24.9 ptt? -96.15 -18.74 19.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.5 177.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.525 ' HG2' ' HG3' ' A' ' 27' ' ' MET . 33.1 mm-40 -108.86 101.73 10.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.694 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 74.3 mm-40 -104.21 125.0 50.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.667 178.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.434 ' HB2' ' HE3' ' A' ' 30' ' ' LYS . 34.1 ttmt -85.93 -76.19 0.35 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.973 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.5 p -141.64 -46.04 0.36 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.144 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' B' ' 457' ' ' ARG . 58.5 t -86.76 143.78 10.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.301 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.854 ' HB ' ' HD2' ' A' ' 34' ' ' PRO . 1.1 pp -126.8 169.19 12.51 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.288 -177.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.854 ' HD2' ' HB ' ' A' ' 33' ' ' ILE . 59.2 Cg_endo -71.13 159.75 51.24 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.833 2.355 . . . . 0.0 114.409 -173.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -148.35 -136.71 2.76 Favored Glycine 0 C--N 1.332 0.34 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.413 175.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.68 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 26.9 ttt -154.79 -58.56 0.02 OUTLIER Pre-proline 0 CA--C 1.536 0.435 0 CA-C-N 116.871 0.335 . . . . 0.0 111.593 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.68 ' HD3' ' HB3' ' A' ' 36' ' ' MET . 93.6 Cg_endo -81.81 124.06 4.38 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 121.776 1.65 . . . . 0.0 111.872 177.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.702 ' HB ' ' HA ' ' B' ' 460' ' ' VAL . 41.0 p -130.5 -22.17 2.76 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.65 -177.192 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.2 m -53.37 120.73 1.95 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-O 121.299 0.571 . . . . 0.0 111.999 -176.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.885 ' H ' ' HG2' ' B' ' 462' ' ' LYS . 58.8 mt -109.48 122.75 38.53 Favored Pre-proline 0 CA--C 1.532 0.261 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.495 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.477 ' O ' HD23 ' A' ' 44' ' ' LEU . 52.6 Cg_exo -55.23 157.57 13.85 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 123.767 2.978 . . . . 0.0 113.606 -177.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.487 ' HB3' ' HE1' ' B' ' 475' ' ' TRP . 46.5 Cg_endo -70.97 112.48 3.3 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.719 2.28 . . . . 0.0 113.477 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 124.02 54.53 0.19 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.574 175.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.482 ' HB3' ' HG3' ' A' ' 49' ' ' GLU . 3.6 mm? -126.89 150.02 49.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.93 0.395 . . . . 0.0 111.479 -175.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.423 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 7.6 p -90.76 155.93 18.44 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.35 173.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.525 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -63.01 -31.29 72.4 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 120.933 0.397 . . . . 0.0 111.388 -174.253 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.423 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.35 -45.06 61.53 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.29 -33.49 73.27 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.763 -177.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.482 ' HG3' ' HB3' ' A' ' 44' ' ' LEU . 43.6 mt-10 -61.04 -44.54 97.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.21 177.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.558 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.77 -43.38 98.94 Favored 'General case' 0 C--O 1.185 -2.318 0 CA-C-O 118.884 -0.579 . . . . 0.0 110.234 177.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.551 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.41 -43.41 88.62 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 123.739 0.65 . . . . 0.0 111.535 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -65.4 -39.07 91.74 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.858 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.684 ' HA ' HD23 ' A' ' 56' ' ' LEU . 36.0 mm -78.64 -41.09 24.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.365 -178.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.1 m -65.57 -35.5 75.39 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.84 0 CA-C-O 118.664 -0.684 . . . . 0.0 111.898 176.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.05 -43.04 91.65 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.509 0.595 . . . . 0.0 110.353 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.684 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.3 OUTLIER -64.93 -38.62 91.56 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.646 177.55 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.51 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 9.3 mt-30 -75.14 -30.37 60.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.421 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.47 HD13 HD13 ' A' ' 113' ' ' ILE . 72.5 mt -65.8 -47.02 87.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 122.836 0.454 . . . . 0.0 110.341 175.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.42 -41.16 85.3 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.64 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -70.33 -31.37 68.64 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.225 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.791 ' HG ' HG12 ' A' ' 33' ' ' ILE . 17.8 mt -67.64 -44.92 76.76 Favored 'General case' 0 C--O 1.207 -1.162 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 172.678 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.5 -35.81 82.0 Favored 'General case' 0 N--CA 1.432 -1.346 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -178.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.501 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.79 -42.76 76.05 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.537 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.79 -47.76 83.68 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 113.846 -1.524 . . . . 0.0 111.93 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.416 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.04 -29.0 63.73 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.867 176.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.96 -47.13 69.47 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.501 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.07 -17.69 14.41 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 119.974 -0.69 . . . . 0.0 112.815 -177.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.89 29.41 10.6 Favored Glycine 0 C--N 1.315 -0.621 0 C-N-CA 119.896 -1.145 . . . . 0.0 111.254 -177.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.4 92.95 7.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.214 0.531 . . . . 0.0 110.135 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.8 tp -103.39 -39.69 6.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.536 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.98 108.54 3.18 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.781 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.438 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 43.2 mm -105.81 113.2 64.13 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 110.655 177.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 72' ' ' ILE . 8.3 Cg_exo -72.47 150.08 51.2 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.065 2.51 . . . . 0.0 112.4 179.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.73 144.7 97.82 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.906 2.404 . . . . 0.0 112.532 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 65.8 t30 65.34 99.73 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.458 0 O-C-N 123.722 0.639 . . . . 0.0 110.784 -176.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.64 173.73 13.86 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.85 2.366 . . . . 0.0 113.22 -176.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -95.3 156.95 16.1 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.048 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 62.33 -164.34 0.25 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.026 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -82.41 -53.45 5.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 0.0 110.048 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 m -126.28 115.46 23.53 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.29 159.64 46.27 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.875 2.383 . . . . 0.0 112.973 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.411 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 36.2 t -59.87 137.12 90.46 Favored Pre-proline 0 CA--C 1.532 0.261 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.476 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 82' ' ' SER . 50.3 Cg_exo -54.55 130.25 39.14 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.36 2.707 . . . . 0.0 112.981 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.585 ' HB3' ' HD3' ' A' ' 85' ' ' PRO . 22.3 tt0 -125.65 -54.8 0.03 OUTLIER Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.174 -176.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.585 ' HD3' ' HB3' ' A' ' 84' ' ' GLU . 3.6 Cg_exo -75.26 -28.38 8.8 Favored 'Trans proline' 0 C--N 1.362 1.26 0 C-N-CA 122.589 2.193 . . . . 0.0 113.363 -177.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.9 mm -77.89 126.32 38.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.85 0.357 . . . . 0.0 111.191 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -127.8 135.99 50.86 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.601 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -81.62 115.89 21.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.094 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 89.2 p -74.56 -30.41 61.72 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.375 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -83.02 -67.96 0.74 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.022 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 127.68 114.98 1.87 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.791 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.7 tttp -117.24 -32.55 4.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.106 0.479 . . . . 0.0 110.261 177.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -118.97 -169.45 1.73 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.36 178.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 mt -105.72 171.77 7.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.769 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -76.34 100.77 5.25 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.163 175.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -136.22 -50.13 0.68 Allowed 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 115.738 -0.664 . . . . 0.0 112.73 -175.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.09 -52.53 16.36 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.218 -0.926 . . . . 0.0 109.667 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.462 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.6 mp0 -53.34 -51.74 61.46 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-N 113.614 -1.63 . . . . 0.0 110.66 -178.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -66.61 -38.75 87.63 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 113.456 -1.702 . . . . 0.0 110.653 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.533 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.87 -44.51 94.12 Favored 'General case' 0 CA--C 1.512 -0.495 0 O-C-N 123.265 0.353 . . . . 0.0 110.356 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.728 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.8 m -69.02 -50.05 52.26 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 120.069 -0.653 . . . . 0.0 110.637 179.057 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.45 -41.24 93.66 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -175.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.08 -39.1 89.78 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.19 -40.16 89.07 Favored 'General case' 0 C--O 1.223 -0.308 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.728 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.93 -41.09 97.73 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.648 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.0 -34.45 78.47 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.73 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.44 -34.29 74.21 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.55 -48.79 76.05 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.607 -1.256 . . . . 0.0 107.607 175.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.559 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.24 -45.54 94.11 Favored 'General case' 0 C--O 1.213 -0.819 0 CA-C-N 114.494 -1.23 . . . . 0.0 110.436 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.28 -37.42 85.46 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.565 0.746 . . . . 0.0 110.99 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.78 -43.74 85.78 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.7 mt -72.23 -38.63 68.92 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.769 177.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.559 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.39 -50.91 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 110.51 -0.181 . . . . 0.0 110.51 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.5 m -60.7 -39.46 88.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.195 0.521 . . . . 0.0 110.535 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.611 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.52 61.24 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.004 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.43 -37.09 84.41 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.8 t -65.54 -36.86 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 176.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.72 80.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.226 0.536 . . . . 0.0 110.23 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.7 mt -71.61 -40.5 69.77 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.984 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.58 111.19 12.53 Favored Pre-proline 0 C--N 1.315 -0.896 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.013 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.68 -22.81 36.99 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.837 2.358 . . . . 0.0 112.558 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.16 0.01 55.98 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.191 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.94 134.7 54.53 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.617 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.39 109.07 62.8 Favored Pre-proline 0 CA--C 1.51 -0.589 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.32 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.23 157.93 59.67 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 122.261 1.974 . . . . 0.0 111.501 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.64 154.5 25.23 Favored 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 123.626 2.884 . . . . 0.0 111.768 177.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.08 -31.37 70.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -91.77 34.96 0.97 Allowed 'General case' 0 C--O 1.233 0.22 0 O-C-N 123.474 0.484 . . . . 0.0 111.618 -177.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -73.51 125.32 27.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.215 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -106.86 111.6 63.72 Favored Pre-proline 0 C--O 1.234 0.238 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.247 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -77.94 158.36 30.93 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.401 2.734 . . . . 0.0 112.201 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -64.2 161.46 33.89 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.75 2.3 . . . . 0.0 112.789 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . 61.06 -148.44 0.42 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.56 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.7 m 71.14 95.74 0.07 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.964 178.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -109.4 -41.97 4.47 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.38 175.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 22.5 m -101.08 162.11 3.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.406 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 74.4 m -126.2 130.39 50.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.455 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -78.26 98.4 5.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.112 0.482 . . . . 0.0 110.682 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 57.5 tttm -102.1 124.61 47.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.173 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 16.1 m -83.99 144.32 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.585 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.13 133.74 23.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.027 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 18.6 pt -85.5 153.68 58.84 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.233 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -57.18 133.04 54.97 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.926 2.417 . . . . 0.0 112.697 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -80.81 127.43 32.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.019 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.068 -0.968 . . . . 0.0 111.01 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 N-CA-C 112.669 -0.172 . . . . 0.0 112.669 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 373' ' ' HIS . . . . . 0.455 ' HA ' ' HD3' ' B' ' 374' ' ' PRO . 95.9 m-70 -86.48 134.12 38.72 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.596 0.198 . . . . 0.0 110.905 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 374' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' B' ' 373' ' ' HIS . 31.8 Cg_exo -59.5 147.6 90.77 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.985 2.457 . . . . 0.0 112.529 178.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 375' ' ' THR . . . . . 0.468 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -143.35 -71.42 0.31 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.179 -177.557 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 376' ' ' GLU . . . . . 0.485 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.9 -45.91 0.01 OUTLIER 'General case' 0 C--O 1.231 0.108 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 377' ' ' VAL . . . . . 0.558 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.95 7.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.478 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 378' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.63 152.5 20.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.193 -178.989 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 379' ' ' CYS . . . . . 0.604 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.53 142.53 46.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.631 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.61 HD23 HG22 ' B' ' 461' ' ' THR . 5.3 mt -132.71 102.33 5.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.377 . . . . 0.0 111.01 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 21.6 ttt -117.15 164.89 14.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.26 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.2 t30 58.15 51.12 8.97 Favored 'General case' 0 C--O 1.232 0.154 0 O-C-N 123.338 0.399 . . . . 0.0 111.278 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 383' ' ' MET . . . . . 0.79 ' HB3' HG12 ' B' ' 459' ' ' VAL . 3.0 ptm -164.86 14.37 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.258 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 384' ' ' VAL . . . . . 0.733 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.27 125.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 0.0 111.372 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.83 151.7 43.08 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.4 179.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.07 -23.52 73.62 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.353 2.035 . . . . 0.0 112.36 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.89 -5.48 53.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.494 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.77 5.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.872 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 389' ' ' LEU . . . . . 0.473 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.97 0.46 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.969 0.414 . . . . 0.0 110.615 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.58 -15.72 5.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.652 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.36 148.76 23.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.542 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -73.57 -30.16 62.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.276 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.42 -47.66 26.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.713 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.6 -44.25 91.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.743 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.44 -59.32 5.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.221 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -27.38 61.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.27 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.08 -41.06 67.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.423 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 398' ' ' ILE . . . . . 0.493 HD13 HG12 ' B' ' 384' ' ' VAL . 65.5 mt -74.94 -53.64 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.516 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 399' ' ' VAL . . . . . 0.615 HG22 HD12 ' B' ' 417' ' ' ILE . 59.4 t -53.25 -46.98 57.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.807 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.42 -60.0 3.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.789 0.328 . . . . 0.0 111.523 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.52 -57.31 11.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.359 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.01 -32.96 15.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.326 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 403' ' ' ARG . . . . . 0.46 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.2 OUTLIER -71.18 -57.38 4.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.715 0.293 . . . . 0.0 111.149 -179.919 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.93 -33.69 64.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.15 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 405' ' ' GLU . . . . . 0.549 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.43 -47.02 45.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.96 -23.87 67.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.171 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.39 1.1 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.966 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.1 -17.17 12.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.877 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.61 -15.47 14.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.561 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.12 -139.41 4.15 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.536 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.29 132.46 56.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.714 0.292 . . . . 0.0 111.065 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 412' ' ' VAL . . . . . 0.433 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.39 115.46 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.991 0.424 . . . . 0.0 110.58 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 413' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.64 -61.93 2.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.226 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.04 -169.4 3.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.109 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 415' ' ' ILE . . . . . 0.617 HG23 HG12 ' B' ' 434' ' ' VAL . 48.8 mt -145.09 128.83 11.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 416' ' ' GLU . . . . . 0.436 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.78 108.83 18.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.732 179.781 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 417' ' ' ILE . . . . . 1.008 HG23 HG21 ' B' ' 432' ' ' ILE . 60.5 mt -128.53 108.47 19.04 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.708 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 418' ' ' PRO . . . . . 0.632 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.5 147.6 9.01 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.663 2.242 . . . . 0.0 112.904 -179.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.84 74.75 22.06 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.143 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.27 117.11 2.07 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.79 2.327 . . . . 0.0 112.402 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 421' ' ' VAL . . . . . 0.581 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.5 t -74.39 97.78 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.187 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.57 21.82 9.06 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.557 0.694 . . . . 0.0 109.314 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 423' ' ' GLY . . . . . 0.648 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.39 29.22 6.07 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.278 -179.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 424' ' ' VAL . . . . . 0.581 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.5 -37.6 30.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.103 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.84 35.97 4.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.804 0.335 . . . . 0.0 111.753 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 426' ' ' VAL . . . . . 0.667 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.39 -44.63 47.0 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.819 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 427' ' ' PRO . . . . . 0.667 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.33 77.07 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.473 2.115 . . . . 0.0 111.107 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.31 -15.38 3.21 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.313 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.2 t -67.52 149.39 50.23 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.511 0.196 . . . . 0.0 110.885 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.5 -14.27 5.06 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.912 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.37 126.17 44.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.845 0.355 . . . . 0.0 111.08 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 432' ' ' ILE . . . . . 1.008 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.08 172.93 15.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.281 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 433' ' ' PHE . . . . . 0.604 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.37 2.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.958 0.409 . . . . 0.0 111.962 -178.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 434' ' ' VAL . . . . . 0.617 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.82 141.72 41.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.176 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 435' ' ' GLU . . . . . 0.486 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.4 108.55 17.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.821 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.78 168.37 12.52 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.249 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 437' ' ' THR . . . . . 0.698 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -94.96 -45.43 7.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.404 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.85 146.69 52.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.128 0.489 . . . . 0.0 111.183 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.22 -12.84 16.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.192 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.8 26.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.123 0.487 . . . . 0.0 110.129 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.15 -29.44 60.48 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.889 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.14 -31.81 72.34 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.186 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -78.69 -48.03 15.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.646 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.07 59.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.709 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.83 -54.9 3.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.961 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 446' ' ' MET . . . . . 0.474 ' HB3' HD21 ' B' ' 378' ' ' LEU . 4.1 ptm -64.76 -27.57 68.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.957 -179.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.58 -16.2 63.36 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.64 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.66 -8.53 22.57 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.464 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 449' ' ' LEU . . . . . 0.408 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.3 mt -95.82 -19.77 19.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.712 0.291 . . . . 0.0 110.916 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 450' ' ' THR . . . . . 0.448 HG22 ' OG1' ' A' ' 38' ' ' THR . 23.1 p -69.54 131.36 44.57 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.104 175.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.63 -9.59 76.66 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.677 -0.773 . . . . 0.0 113.377 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 452' ' ' ARG . . . . . 0.427 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -75.74 -152.2 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 117.2 0.5 . . . . 0.0 110.513 178.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 453' ' ' LYS . . . . . 0.486 ' HZ1' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -160.87 117.15 2.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.948 0.404 . . . . 0.0 111.338 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.23 -36.4 75.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.542 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.21 -50.98 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.846 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.25 25.0 0.3 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.787 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 457' ' ' ARG . . . . . 0.623 ' HB3' ' HB ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -149.47 136.22 19.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.325 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 7.2 p -58.38 132.23 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 121.124 0.488 . . . . 0.0 110.949 178.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 459' ' ' VAL . . . . . 0.79 HG12 ' HB3' ' B' ' 383' ' ' MET . 0.9 OUTLIER -90.99 122.12 42.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.819 -174.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 460' ' ' VAL . . . . . 0.702 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 59.6 t -88.89 98.21 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.319 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 461' ' ' THR . . . . . 0.61 HG22 HD23 ' B' ' 380' ' ' LEU . 1.4 p -98.12 129.64 44.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.842 177.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 462' ' ' LYS . . . . . 0.885 ' HG2' ' H ' ' A' ' 40' ' ' ILE . 0.5 OUTLIER -130.58 -166.35 1.67 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.268 0.556 . . . . 0.0 111.148 -179.045 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.59 146.93 37.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.525 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 464' ' ' CYS . . . . . 0.626 ' SG ' ' HB3' ' B' ' 475' ' ' TRP . 0.5 OUTLIER -136.81 148.98 47.48 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.065 0.46 . . . . 0.0 111.378 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 465' ' ' ASP . . . . . 0.468 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.46 129.35 66.42 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.398 -179.881 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 466' ' ' PRO . . . . . 0.485 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.06 -33.21 72.62 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.685 2.257 . . . . 0.0 112.103 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.07 -58.48 7.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.38 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.5 -33.67 68.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.25 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 469' ' ' TYR . . . . . 0.486 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.1 -51.18 70.7 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.183 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.37 -47.53 69.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.37 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 471' ' ' ARG . . . . . 0.451 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.73 -2.09 49.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.45 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.09 20.8 8.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.975 0.417 . . . . 0.0 110.275 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 473' ' ' ASP . . . . . 0.451 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.85 -21.48 29.49 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.954 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 70.05 157.29 0.16 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.121 0.568 . . . . 0.0 111.264 -177.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 475' ' ' TRP . . . . . 0.626 ' HB3' ' SG ' ' B' ' 464' ' ' CYS . 44.0 t-105 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.359 -0.829 . . . . 0.0 111.226 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.1 mtp . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 120.446 0.165 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 61.41 -101.42 0.11 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.771 0.669 . . . . 0.0 111.84 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 t -147.42 -9.64 0.43 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.197 0.523 . . . . 0.0 110.422 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.73 -4.89 0.11 Allowed Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.208 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 60.46 -160.13 0.3 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.945 0.498 . . . . 0.0 111.73 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -85.8 148.22 25.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.421 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.91 143.82 32.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.05 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.412 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.0 t -72.34 128.52 88.69 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.795 178.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 31.2 Cg_exo -59.88 137.8 78.64 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.944 2.429 . . . . 0.0 112.652 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 10' ' ' LEU . 11.9 tp -98.44 16.14 22.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.056 177.229 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -75.19 -43.71 50.58 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.785 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 31.3 p90 -78.55 146.22 69.13 Favored Pre-proline 0 C--O 1.233 0.189 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.279 176.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 38.8 Cg_exo -56.52 115.56 2.57 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 123.265 2.643 . . . . 0.0 112.323 -174.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.92 12.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.94 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.36 -36.27 3.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.995 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.8 2.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.856 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.84 -54.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.812 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.9 111.13 13.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.94 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.92 125.59 24.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.697 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.62 12.88 19.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.992 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.553 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.8 m95 -142.06 53.02 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.706 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.29 -156.54 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.84 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.471 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.33 -37.63 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.867 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.75 121.29 42.86 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.557 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 p -121.99 -64.63 1.19 Allowed 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.625 0.578 . . . . 0.0 111.067 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mpt? 59.67 29.23 18.78 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.636 0.585 . . . . 0.0 111.421 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -103.45 -57.7 2.0 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.22 178.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -156.95 172.17 19.14 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.259 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 44.2 mtpt 63.53 -157.43 0.32 Allowed 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.468 0.48 . . . . 0.0 111.715 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 40.0 p -92.94 130.6 38.47 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.868 0.366 . . . . 0.0 111.559 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.1 p -127.53 135.42 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.371 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.666 ' H ' ' HZ1' ' B' ' 453' ' ' LYS . 0.0 OUTLIER -143.84 136.42 13.5 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.418 177.593 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.619 ' HD2' HG12 ' A' ' 33' ' ' ILE . 76.1 Cg_exo -52.27 160.2 3.6 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 123.227 2.618 . . . . 0.0 113.367 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -73.52 89.49 0.63 Allowed Glycine 0 N--CA 1.451 -0.346 0 CA-C-N 115.776 -0.647 . . . . 0.0 113.125 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.436 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 24.0 mmt -115.33 133.61 22.7 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 120.641 0.258 . . . . 0.0 111.132 178.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 36' ' ' MET . 24.6 Cg_exo -63.78 134.91 45.9 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.903 2.402 . . . . 0.0 111.955 176.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.6 t -153.93 23.82 0.5 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.957 0.408 . . . . 0.0 110.949 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.645 ' HA ' HG12 ' B' ' 460' ' ' VAL . 2.7 m -52.84 119.76 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.257 -176.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.858 HG13 HG11 ' B' ' 460' ' ' VAL . 84.2 mt -64.85 132.78 95.55 Favored Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.135 177.016 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.507 ' HA ' ' HD3' ' A' ' 42' ' ' PRO . 26.1 Cg_exo -64.56 147.38 90.24 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 122.67 2.247 . . . . 0.0 112.198 175.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 9.8 Cg_exo -72.31 104.59 1.71 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.916 2.41 . . . . 0.0 113.019 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 136.1 46.51 0.09 OUTLIER Glycine 0 C--N 1.333 0.382 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.46 176.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 44' ' ' LEU . 3.4 mm? -121.63 156.84 32.11 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.927 0.394 . . . . 0.0 111.521 -176.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.459 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 1.4 p -84.93 154.27 22.31 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.605 175.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.522 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.06 -31.3 71.71 Favored 'General case' 0 C--O 1.24 0.597 0 O-C-N 123.368 0.418 . . . . 0.0 111.395 -175.029 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.459 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.3 -45.23 60.91 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.18 -32.69 72.17 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.753 -177.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.454 ' O ' HG12 ' A' ' 53' ' ' ILE . 36.1 mt-10 -61.16 -44.78 96.78 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.243 178.01 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.561 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.37 -43.32 97.94 Favored 'General case' 0 C--O 1.186 -2.252 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.235 177.256 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.552 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.43 -42.13 86.61 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 123.719 0.637 . . . . 0.0 111.585 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -66.29 -38.86 88.76 Favored 'General case' 0 N--CA 1.462 0.165 0 O-C-N 123.824 0.703 . . . . 0.0 110.933 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.598 ' HA ' HD23 ' A' ' 56' ' ' LEU . 29.6 mm -78.31 -41.52 26.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.197 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.561 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -66.41 -35.44 74.92 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.809 0 CA-C-O 118.586 -0.721 . . . . 0.0 111.958 177.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.15 -45.43 90.99 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 118.541 0.61 . . . . 0.0 110.308 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.598 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.1 OUTLIER -70.55 -23.71 62.67 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.077 -178.321 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -89.53 -26.67 20.75 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.669 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.487 HD13 HD13 ' A' ' 113' ' ' ILE . 72.7 mt -64.04 -46.94 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.175 0.59 . . . . 0.0 110.395 170.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.433 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.45 -41.15 85.17 Favored 'General case' 0 CA--C 1.513 -0.474 0 C-N-CA 120.294 -0.563 . . . . 0.0 110.685 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -36.5 83.11 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.844 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.529 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -66.61 -44.95 80.71 Favored 'General case' 0 C--O 1.206 -1.187 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.51 -35.81 81.98 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.82 -42.76 76.19 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 122.095 0.95 . . . . 0.0 108.53 176.249 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.529 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.76 -47.73 83.88 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 113.827 -1.533 . . . . 0.0 111.897 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.423 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.23 -28.79 63.39 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 119.741 -0.784 . . . . 0.0 111.831 176.99 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -68.1 -47.07 69.19 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.48 14.46 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 119.965 -0.694 . . . . 0.0 112.86 -177.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.77 29.41 10.74 Favored Glycine 0 C--N 1.316 -0.565 0 C-N-CA 119.804 -1.188 . . . . 0.0 111.28 -177.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.4 91.08 6.77 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.253 0.549 . . . . 0.0 110.215 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -122.68 -32.43 3.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.454 178.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 138.2 -168.12 24.71 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.354 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.481 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 44.6 mm -94.79 113.11 60.41 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.796 0.331 . . . . 0.0 110.687 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 72' ' ' ILE . 5.8 Cg_exo -79.54 152.61 23.13 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 123.087 2.525 . . . . 0.0 112.253 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.6 -28.55 52.78 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.713 2.275 . . . . 0.0 112.279 177.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -100.21 124.79 41.92 Favored Pre-proline 0 CA--C 1.53 0.191 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.708 178.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.22 143.42 53.4 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.883 2.389 . . . . 0.0 112.33 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -110.32 -31.42 7.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.36 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -124.17 31.09 5.89 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.864 -176.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 85.1 mtt180 -124.02 -27.28 3.91 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.658 0.266 . . . . 0.0 111.57 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.8 p -88.88 153.81 49.73 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.935 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.52 130.89 35.42 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.05 2.5 . . . . 0.0 112.486 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 29.3 t -138.64 93.64 10.84 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.127 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -90.28 121.83 0.92 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.264 2.642 . . . . 0.0 112.686 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -148.43 106.72 3.55 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.948 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo -72.97 151.63 50.62 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.918 2.412 . . . . 0.0 112.066 177.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.8 pt -89.92 109.82 21.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.102 0.477 . . . . 0.0 111.575 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -128.21 -41.75 1.56 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.241 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -103.83 134.23 47.49 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.55 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 57.9 m -71.0 -47.52 58.31 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.295 -177.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -103.73 88.58 3.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.026 0.441 . . . . 0.0 110.498 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -91.34 165.67 30.22 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.659 -177.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 89.6 mttt 60.27 85.2 0.11 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.158 0.504 . . . . 0.0 111.699 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -112.71 5.06 17.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.864 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -103.58 -78.37 0.55 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.959 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 66.79 104.2 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.316 0.647 . . . . 0.0 112.374 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -111.86 -50.19 2.93 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.774 174.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.11 -52.5 16.46 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.261 -0.9 . . . . 0.0 109.706 -178.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.458 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.3 mp0 -53.34 -51.7 61.58 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-N 113.663 -1.608 . . . . 0.0 110.656 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.64 -38.75 87.55 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.435 -1.712 . . . . 0.0 110.704 -177.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.53 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.83 -44.59 93.98 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 123.237 0.336 . . . . 0.0 110.371 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.722 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.7 m -69.05 -50.0 52.49 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.613 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.46 -41.27 93.55 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -175.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.0 -39.17 90.05 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 110.351 -0.241 . . . . 0.0 110.351 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 100' ' ' ARG . 6.2 tmtt? -60.23 -40.13 89.12 Favored 'General case' 0 C--O 1.223 -0.308 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.93 -41.06 97.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.135 -0.938 . . . . 0.0 110.663 178.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.01 -34.36 78.26 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.811 178.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.52 -34.29 74.05 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 177.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.45 -48.86 75.99 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 175.425 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.559 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.2 ttp180 -61.26 -45.51 94.21 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.441 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.21 -37.47 85.47 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 123.567 0.747 . . . . 0.0 111.016 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.79 -43.73 85.8 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.8 mt -72.3 -38.49 68.73 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.814 177.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.559 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.4 -50.98 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 110.472 -0.195 . . . . 0.0 110.472 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.9 m -60.6 -39.6 88.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.219 0.533 . . . . 0.0 110.514 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.608 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.89 -49.64 60.83 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.952 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.1 84.46 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.3 t -65.52 -36.87 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 176.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.7 79.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.197 0.523 . . . . 0.0 110.22 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.3 mt -71.46 -40.56 70.23 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.045 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.63 111.22 12.48 Favored Pre-proline 0 C--N 1.316 -0.853 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.76 -22.63 36.8 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.861 2.374 . . . . 0.0 112.588 -178.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.34 0.07 55.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.405 0.621 . . . . 0.0 111.178 -177.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.84 134.61 54.43 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.61 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.35 109.16 62.89 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.323 177.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.27 157.92 59.76 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.271 1.981 . . . . 0.0 111.501 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.56 154.5 24.82 Favored 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 123.648 2.899 . . . . 0.0 111.813 177.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.1 -31.49 71.13 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -90.08 20.73 4.1 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 123.771 0.669 . . . . 0.0 111.733 -176.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -74.15 119.86 18.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.815 0.34 . . . . 0.0 110.151 175.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 131' ' ' PRO . 53.2 tttt -108.74 120.0 47.46 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.919 -178.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 130' ' ' LYS . 18.7 Cg_exo -66.34 135.51 40.04 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 123.049 2.5 . . . . 0.0 112.424 179.409 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 24.7 Cg_exo -64.24 -43.8 13.71 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.181 2.587 . . . . 0.0 112.81 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -127.7 125.84 40.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.977 0.417 . . . . 0.0 111.278 -179.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 27.9 p -111.44 125.73 54.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.906 178.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -88.14 161.0 17.53 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.239 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 17.5 m -89.02 -20.65 7.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.419 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 71.3 m -116.99 98.52 6.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.792 0.33 . . . . 0.0 110.896 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -100.01 110.07 22.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.597 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 12.2 pttm -79.47 -22.02 44.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.626 -178.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 2.7 m -81.55 121.81 35.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.105 0.479 . . . . 0.0 111.152 178.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 21.8 mmt -110.67 155.84 21.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 -178.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.766 HD13 ' H ' ' A' ' 142' ' ' ILE . 0.2 OUTLIER -95.04 147.65 33.39 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.556 177.041 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 142' ' ' ILE . 24.6 Cg_exo -63.59 131.54 31.97 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.678 2.252 . . . . 0.0 112.11 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -104.79 162.36 13.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.029 -179.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.432 -0.794 . . . . 0.0 110.964 -179.634 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.145 0 N-CA-C 112.599 -0.2 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -94.63 132.7 28.11 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 120.679 0.276 . . . . 0.0 111.148 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -69.05 142.68 51.78 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.943 2.429 . . . . 0.0 112.973 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 375' ' ' THR . . . . . 0.454 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -120.84 -71.3 0.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.166 178.638 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 376' ' ' GLU . . . . . 0.492 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.96 0.01 OUTLIER 'General case' 0 C--O 1.231 0.097 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 377' ' ' VAL . . . . . 0.554 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.95 7.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.471 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 378' ' ' LEU . . . . . 0.49 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.55 152.54 20.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.271 -179.072 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 379' ' ' CYS . . . . . 0.611 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.57 142.53 46.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.59 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.51 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.73 101.82 5.43 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.925 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 381' ' ' MET . . . . . 0.403 ' HG2' ' N ' ' B' ' 382' ' ' ASN . 20.3 ttt -116.83 164.7 14.27 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.59 -178.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 382' ' ' ASN . . . . . 0.403 ' N ' ' HG2' ' B' ' 381' ' ' MET . 13.1 t30 58.58 51.19 8.14 Favored 'General case' 0 C--N 1.342 0.278 0 O-C-N 123.479 0.487 . . . . 0.0 111.316 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 383' ' ' MET . . . . . 0.433 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.85 14.4 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.253 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 384' ' ' VAL . . . . . 0.737 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.31 125.17 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.845 0.355 . . . . 0.0 111.311 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.412 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.0 mt -110.78 151.78 43.1 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.34 179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.25 -23.35 72.5 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.273 1.982 . . . . 0.0 112.343 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.94 -5.52 53.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.484 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.02 -36.76 5.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.904 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 389' ' ' LEU . . . . . 0.477 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.96 34.92 0.46 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.913 0.387 . . . . 0.0 110.636 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.55 -15.66 5.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.659 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.31 148.71 23.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.573 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -73.5 -30.25 63.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.225 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.35 -47.68 26.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.754 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.51 -44.26 91.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.852 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.41 -59.45 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.162 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -27.29 61.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.275 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.23 -40.94 67.39 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.429 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 398' ' ' ILE . . . . . 0.496 HD13 HG12 ' B' ' 384' ' ' VAL . 65.5 mt -74.93 -53.65 16.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.525 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 399' ' ' VAL . . . . . 0.617 HG22 HD12 ' B' ' 417' ' ' ILE . 59.7 t -53.3 -46.86 57.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.846 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.47 -60.0 3.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.74 0.305 . . . . 0.0 111.526 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.69 -57.14 11.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.341 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.7 t -52.04 -32.99 15.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.387 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 403' ' ' ARG . . . . . 0.46 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.15 -57.39 4.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 111.173 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.9 -33.62 64.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.214 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 405' ' ' GLU . . . . . 0.553 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 22.0 mm-40 -73.48 -47.06 44.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.963 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.81 -23.97 67.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.131 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.08 30.25 1.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.895 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.01 -17.18 12.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.42 14.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.551 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.14 -139.46 4.17 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.553 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.21 132.51 56.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.09 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 412' ' ' VAL . . . . . 0.422 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.38 115.45 48.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.028 0.442 . . . . 0.0 110.658 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 413' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.69 -61.97 2.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.179 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.96 -169.33 3.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.188 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 415' ' ' ILE . . . . . 0.613 HG23 HG12 ' B' ' 434' ' ' VAL . 48.6 mt -145.2 128.94 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.825 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 416' ' ' GLU . . . . . 0.429 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.93 108.76 18.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.692 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 417' ' ' ILE . . . . . 0.969 HG23 HG21 ' B' ' 432' ' ' ILE . 60.1 mt -128.42 108.48 19.24 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.688 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 418' ' ' PRO . . . . . 0.637 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.48 147.61 8.95 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.673 2.248 . . . . 0.0 112.913 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.86 74.61 22.1 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.155 179.899 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.1 117.0 1.96 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.782 2.321 . . . . 0.0 112.46 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 421' ' ' VAL . . . . . 0.599 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.2 t -74.34 97.84 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.199 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.5 21.84 8.99 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.61 0.719 . . . . 0.0 109.386 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 423' ' ' GLY . . . . . 0.634 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.31 29.21 6.1 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.273 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 424' ' ' VAL . . . . . 0.599 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.42 -37.57 31.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.86 35.92 4.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.331 . . . . 0.0 111.825 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 426' ' ' VAL . . . . . 0.677 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.41 -44.59 46.65 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.827 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 427' ' ' PRO . . . . . 0.677 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.8 Cg_endo -66.3 77.07 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.516 2.144 . . . . 0.0 111.113 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.34 -15.47 3.2 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.338 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.53 149.37 50.25 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.591 0.234 . . . . 0.0 110.793 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.54 -14.24 5.05 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.856 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 126.16 44.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.833 0.349 . . . . 0.0 111.028 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 432' ' ' ILE . . . . . 0.969 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -131.03 172.89 15.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.243 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 433' ' ' PHE . . . . . 0.611 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.3 2.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.989 0.423 . . . . 0.0 111.974 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 434' ' ' VAL . . . . . 0.613 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.88 141.71 41.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.207 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 435' ' ' GLU . . . . . 0.484 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.3 108.49 17.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.819 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.79 168.36 12.53 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.227 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 437' ' ' THR . . . . . 0.698 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.93 -45.39 7.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.438 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.91 146.66 52.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.096 0.474 . . . . 0.0 111.215 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.25 -12.7 16.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.263 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.87 25.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.082 0.468 . . . . 0.0 110.088 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.16 -29.37 60.43 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.864 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.32 -31.68 72.32 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.168 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -78.64 -48.06 15.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.649 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.08 59.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.719 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -55.6 3.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.993 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 446' ' ' MET . . . . . 0.49 ' HB3' HD21 ' B' ' 378' ' ' LEU . 3.4 ptm -64.14 -26.98 68.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.178 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.16 -16.25 63.06 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.625 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.51 22.7 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.415 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 449' ' ' LEU . . . . . 0.66 ' HB2' HG21 ' B' ' 461' ' ' THR . 97.2 mt -95.72 -20.55 18.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.797 0.332 . . . . 0.0 110.894 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 3.3 t -72.59 131.72 42.83 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.899 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.98 -9.81 72.53 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.157 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 452' ' ' ARG . . . . . 0.417 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.3 mmm180 -77.11 -152.22 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 117.239 0.52 . . . . 0.0 110.587 178.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 453' ' ' LYS . . . . . 0.666 ' HZ1' ' H ' ' A' ' 33' ' ' ILE . 0.0 OUTLIER -160.83 117.08 2.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.853 0.358 . . . . 0.0 111.285 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.23 -36.43 75.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.524 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.16 -50.92 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.814 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.23 24.86 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.761 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 457' ' ' ARG . . . . . 0.433 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.38 134.77 18.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.344 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 2.8 m -59.65 138.42 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-O 121.042 0.449 . . . . 0.0 111.62 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 57.5 t -98.73 115.79 40.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.419 -176.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 460' ' ' VAL . . . . . 0.858 HG11 HG13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -82.81 114.5 23.75 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.796 174.385 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 461' ' ' THR . . . . . 0.66 HG21 ' HB2' ' B' ' 449' ' ' LEU . 14.1 p -100.96 132.14 46.51 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.139 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 462' ' ' LYS . . . . . 0.416 ' HD2' ' HB ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -127.46 -175.74 3.54 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.727 0.775 . . . . 0.0 111.455 -177.045 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -111.54 146.9 36.5 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.473 172.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 464' ' ' CYS . . . . . 0.554 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 149.03 47.47 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.992 0.425 . . . . 0.0 111.431 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 465' ' ' ASP . . . . . 0.454 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.46 129.36 66.37 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.374 -179.812 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 466' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -53.98 -33.31 72.16 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.76 2.307 . . . . 0.0 112.127 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -58.49 7.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.399 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.44 -33.72 68.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.278 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 469' ' ' TYR . . . . . 0.484 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.03 -51.23 70.54 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.203 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.36 -47.6 69.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.291 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 471' ' ' ARG . . . . . 0.453 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.67 -2.19 49.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.383 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.78 8.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 0.0 110.234 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 473' ' ' ASP . . . . . 0.453 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.66 -20.45 21.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.951 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 11.5 p90 56.29 19.29 3.85 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.82 1.248 . . . . 0.0 112.771 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.828 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.8 tpp . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.808 0.337 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -119.24 97.65 5.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.931 178.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.0 t -91.78 131.25 37.28 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.042 0.449 . . . . 0.0 111.248 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -136.96 -44.39 0.09 OUTLIER Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.599 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -87.16 -16.02 36.64 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.503 0.192 . . . . 0.0 111.106 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 65.02 -172.57 0.18 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.686 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -104.68 -21.35 13.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.593 178.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.404 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.2 t -127.15 132.33 24.27 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.082 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 20.0 Cg_exo -66.61 142.9 66.31 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.857 2.371 . . . . 0.0 112.09 176.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.8 mp -74.61 109.93 8.49 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.878 0.37 . . . . 0.0 111.107 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -152.06 119.6 6.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.633 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -95.33 151.49 38.71 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.948 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.28 115.57 2.57 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.936 2.424 . . . . 0.0 112.25 172.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.02 -166.75 1.32 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.859 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.91 12.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.878 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.3 -36.29 3.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.043 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.76 91.89 2.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.855 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.9 -54.33 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.786 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.82 111.24 13.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.01 125.63 25.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.787 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.59 12.78 19.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.976 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.552 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.4 m95 -141.97 53.08 1.48 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.791 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -156.58 0.13 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.854 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.475 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.33 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.927 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.73 120.36 39.81 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.609 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . 1.025 ' HB ' HG21 ' A' ' 32' ' ' VAL . 2.9 m -145.78 147.4 31.83 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 123.655 0.597 . . . . 0.0 110.782 -177.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.61 ' HG3' ' HG3' ' A' ' 28' ' ' GLU . 9.7 tpt -123.94 130.64 52.91 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.495 -177.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.61 ' HG3' ' HG3' ' A' ' 27' ' ' MET . 48.3 mt-10 75.3 -32.09 0.21 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 174.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -81.59 96.34 7.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.728 0.299 . . . . 0.0 111.262 -177.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? 64.21 -176.04 0.16 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.846 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 37.9 p -89.52 106.09 18.23 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.073 0.463 . . . . 0.0 111.035 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 1.025 HG21 ' HB ' ' A' ' 26' ' ' THR . 48.6 t -106.01 103.28 15.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.73 -174.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.825 ' HB ' ' HZ2' ' A' ' 64' ' ' LYS . 2.2 tp -111.33 104.63 56.36 Favored Pre-proline 0 CA--C 1.54 0.561 0 CA-C-O 121.014 0.435 . . . . 0.0 111.618 176.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -67.17 144.3 68.4 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.966 2.444 . . . . 0.0 112.056 176.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -134.88 -143.98 4.91 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.3 -0.952 . . . . 0.0 113.605 -177.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.79 ' HB3' ' HD2' ' A' ' 37' ' ' PRO . 64.9 mtt -130.9 -177.93 0.75 Allowed Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 122.788 0.435 . . . . 0.0 110.18 -175.297 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.79 ' HD2' ' HB3' ' A' ' 36' ' ' MET . 1.2 Cg_endo -45.22 146.5 2.85 Favored 'Trans proline' 0 C--N 1.365 1.403 0 C-N-CA 122.911 2.408 . . . . 0.0 112.399 172.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.544 ' CB ' ' HA ' ' B' ' 460' ' ' VAL . 16.6 p -131.46 45.41 2.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.674 -169.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.9 m -95.15 112.04 26.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.661 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.823 ' H ' ' HG2' ' B' ' 462' ' ' LYS . 0.4 OUTLIER -80.12 136.79 53.42 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-O 120.883 0.373 . . . . 0.0 110.915 -175.611 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 40' ' ' ILE . 8.0 Cg_exo -73.99 127.67 11.63 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.165 2.576 . . . . 0.0 112.321 178.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 31.6 Cg_exo -60.48 154.33 54.49 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.119 2.546 . . . . 0.0 112.812 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 85.57 50.16 4.1 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.944 -0.646 . . . . 0.0 111.491 -175.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.497 ' CD2' ' HB2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -143.62 163.53 32.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.942 0.401 . . . . 0.0 111.665 -173.454 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.52 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 23.3 p -106.08 163.43 12.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.178 178.403 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.512 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -60.98 -31.39 70.98 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.337 -176.504 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.52 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.32 -45.17 61.13 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.334 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.11 -33.44 73.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.762 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.497 ' HB2' ' CD2' ' A' ' 44' ' ' LEU . 41.6 tt0 -58.89 -46.49 87.73 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.344 177.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.553 ' O ' HG22 ' A' ' 54' ' ' VAL . 16.0 mmt180 -63.21 -43.36 98.34 Favored 'General case' 0 C--O 1.185 -2.304 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.267 177.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.539 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.45 -42.15 86.74 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 123.739 0.649 . . . . 0.0 111.58 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -64.31 -44.98 89.91 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.162 176.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.452 HD13 ' HA ' ' A' ' 53' ' ' ILE . 8.6 mm -71.5 -41.73 72.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.319 -179.273 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.553 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -67.21 -35.64 74.66 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.768 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.835 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.01 -43.32 91.52 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 118.558 0.617 . . . . 0.0 110.277 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.609 ' HG ' ' N ' ' A' ' 57' ' ' GLN . 0.1 OUTLIER -63.23 -41.91 99.16 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.776 176.817 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.609 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 14.4 mt-30 -72.51 -31.27 65.2 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.742 178.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.474 HD13 HD13 ' A' ' 113' ' ' ILE . 73.3 mt -64.51 -47.0 91.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 123.147 0.279 . . . . 0.0 110.447 176.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.46 -41.39 84.76 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.231 -0.588 . . . . 0.0 110.701 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.567 ' HB3' HD11 ' A' ' 33' ' ' ILE . 69.3 m-20 -69.1 -33.61 73.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.176 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.541 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -65.92 -45.0 83.52 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 173.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 m -65.51 -35.73 81.73 Favored 'General case' 0 N--CA 1.433 -1.321 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.496 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.84 -42.75 76.23 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 122.055 0.931 . . . . 0.0 108.505 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.825 ' HZ2' ' HB ' ' A' ' 33' ' ' ILE . 22.1 ttmt -61.85 -47.72 83.75 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 113.837 -1.528 . . . . 0.0 111.871 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.412 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.23 -28.84 63.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.818 177.028 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -67.95 -47.17 69.39 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.496 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.48 14.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.916 -0.714 . . . . 0.0 112.858 -177.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.78 29.41 10.73 Favored Glycine 0 C--N 1.316 -0.575 0 C-N-CA 119.809 -1.186 . . . . 0.0 111.267 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.43 92.11 6.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.227 0.537 . . . . 0.0 110.138 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.2 tp -102.22 -51.99 3.24 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.817 0.341 . . . . 0.0 111.024 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -158.78 -66.82 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.589 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.426 HG12 ' HB2' ' A' ' 27' ' ' MET . 49.3 mm -105.97 114.36 62.72 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.681 0.277 . . . . 0.0 111.146 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.485 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 58.3 Cg_endo -72.38 145.28 42.7 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.672 2.248 . . . . 0.0 111.896 175.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.485 ' HD3' ' HA ' ' A' ' 73' ' ' PRO . 31.9 Cg_exo -59.32 132.72 48.12 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.874 2.382 . . . . 0.0 112.714 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -78.61 151.45 77.23 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.941 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.11 -2.41 11.55 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 123.112 2.541 . . . . 0.0 112.856 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.44 131.04 35.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.717 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -80.15 116.49 20.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.699 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.6 ptp85 -128.25 168.79 14.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.502 -176.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 33.3 t 65.15 94.62 0.05 OUTLIER Pre-proline 0 N--CA 1.469 0.486 0 CA-C-N 115.384 -0.825 . . . . 0.0 112.058 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.29 128.33 11.97 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.689 2.259 . . . . 0.0 111.644 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.413 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 23.1 t -151.88 133.76 8.28 Favored Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.972 -178.095 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 82' ' ' SER . 20.2 Cg_exo -66.04 -49.36 2.11 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.76 2.307 . . . . 0.0 112.187 177.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -119.2 126.4 27.06 Favored Pre-proline 0 CA--C 1.53 0.209 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.436 177.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.13 95.33 0.91 Allowed 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.74 2.293 . . . . 0.0 113.335 -177.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 pt -102.07 106.58 20.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.365 174.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -97.06 -54.36 3.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.52 -172.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -72.16 179.32 3.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.018 0.437 . . . . 0.0 111.977 -173.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 55.6 m -69.24 -19.62 63.95 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.706 -177.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 66.75 -171.02 0.19 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.535 0.522 . . . . 0.0 111.54 177.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 79.12 -118.99 4.92 Favored Glycine 0 C--N 1.331 0.26 0 C-N-CA 121.072 -0.585 . . . . 0.0 112.786 178.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.7 pttm -110.06 -57.28 2.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.571 0.224 . . . . 0.0 111.123 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -98.86 103.12 15.04 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.991 0.424 . . . . 0.0 110.809 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.449 ' H ' ' HG ' ' A' ' 94' ' ' LEU . 1.6 pp -93.74 -12.57 28.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.662 178.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -100.61 94.06 5.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.263 0.554 . . . . 0.0 111.06 -179.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -153.39 -50.19 0.1 Allowed 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.707 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.23 -52.44 16.41 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.191 -0.943 . . . . 0.0 109.603 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.456 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.4 mp0 -53.33 -51.75 61.37 Favored 'General case' 0 CA--C 1.503 -0.836 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.629 -178.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.62 -38.71 87.5 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 113.417 -1.719 . . . . 0.0 110.686 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.526 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.99 -44.45 94.5 Favored 'General case' 0 CA--C 1.511 -0.528 0 O-C-N 123.209 0.318 . . . . 0.0 110.363 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.717 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.4 m -68.99 -50.08 52.11 Favored 'General case' 0 N--CA 1.428 -1.54 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.629 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.44 -41.32 93.61 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -175.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.02 -39.1 89.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.547 0.213 . . . . 0.0 110.432 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.532 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.22 -40.15 89.13 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.717 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.7 mt -63.99 -41.02 97.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.641 178.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.06 -34.39 78.3 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.798 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.4 -34.36 74.37 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 177.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.46 -48.76 76.36 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 175.502 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.54 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.37 -45.41 94.49 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.405 179.063 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.28 -37.47 85.65 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.939 -178.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.76 -43.81 85.7 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.5 mt -72.17 -38.58 69.1 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.749 177.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.54 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.0 mm -57.49 -50.79 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 110.507 -0.182 . . . . 0.0 110.507 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.9 m -60.84 -39.37 88.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.212 0.529 . . . . 0.0 110.523 -179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.609 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -68.0 -49.59 60.66 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.02 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.3 -37.21 84.88 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.5 t -65.41 -36.9 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-O 121.171 0.51 . . . . 0.0 109.657 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.69 -40.69 79.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.2 0.524 . . . . 0.0 110.238 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.0 mt -71.41 -40.56 70.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.118 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.66 111.14 12.43 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.957 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.73 -22.64 36.97 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.78 2.32 . . . . 0.0 112.545 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.38 0.23 55.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.337 0.589 . . . . 0.0 111.151 -177.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -65.02 134.63 54.29 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.623 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.34 109.17 62.91 Favored Pre-proline 0 CA--C 1.509 -0.622 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.276 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -68.31 157.97 59.53 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.317 2.011 . . . . 0.0 111.456 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.69 154.44 25.73 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 123.634 2.889 . . . . 0.0 111.711 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.95 -30.41 69.7 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -173.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -85.54 3.49 40.31 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 123.716 0.635 . . . . 0.0 111.481 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -69.71 127.42 32.89 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.875 0.369 . . . . 0.0 110.644 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -103.55 125.81 33.82 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.701 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.433 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 37.2 Cg_endo -66.13 151.47 83.6 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.625 2.216 . . . . 0.0 112.474 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 31.2 Cg_exo -60.03 135.35 62.17 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.003 2.469 . . . . 0.0 112.566 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -106.32 -44.95 4.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.622 -177.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.4 m -86.73 113.0 22.21 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.955 0.407 . . . . 0.0 111.493 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.9 mtm180 -118.57 119.2 33.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.417 177.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 9.6 p -102.94 139.78 22.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.142 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 26.9 p -139.43 158.8 43.51 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.073 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -112.87 140.86 47.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.87 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -148.55 118.69 7.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.606 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.5 p -151.91 130.55 2.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.429 175.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 22.1 ptm -123.8 167.83 13.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.037 0.446 . . . . 0.0 111.73 -176.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 66.6 mt -112.51 114.94 49.82 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 177.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.29 158.03 57.53 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.73 2.286 . . . . 0.0 113.007 -177.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -86.02 160.01 19.44 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.869 179.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.159 -0.924 . . . . 0.0 110.852 -179.901 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.224 0 N-CA-C 112.662 -0.175 . . . . 0.0 112.662 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 373' ' ' HIS . . . . . 0.425 ' ND1' ' HG2' ' A' ' 42' ' ' PRO . 32.2 m80 -119.78 114.93 33.82 Favored Pre-proline 0 C--N 1.332 -0.19 0 CA-C-O 120.503 0.192 . . . . 0.0 111.148 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.95 134.65 44.15 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.866 2.378 . . . . 0.0 111.699 175.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 375' ' ' THR . . . . . 0.46 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -126.29 -71.35 0.69 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.165 -174.72 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 376' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.9 0.01 OUTLIER 'General case' 0 C--O 1.231 0.095 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 377' ' ' VAL . . . . . 0.561 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.7 150.89 8.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.458 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 378' ' ' LEU . . . . . 0.626 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.57 152.53 20.86 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.276 -179.078 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 379' ' ' CYS . . . . . 0.609 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.49 142.53 46.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.684 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.508 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.71 101.84 5.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.953 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 2.6 tmm? -117.86 166.49 12.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.45 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.2 t30 57.8 51.18 9.52 Favored 'General case' 0 CA--C 1.528 0.105 0 O-C-N 123.599 0.562 . . . . 0.0 111.415 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 383' ' ' MET . . . . . 0.812 ' HB3' HG12 ' B' ' 459' ' ' VAL . 3.0 ptm -164.85 14.33 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.236 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 384' ' ' VAL . . . . . 0.743 HG21 HG23 ' B' ' 432' ' ' ILE . 0.4 OUTLIER -152.27 125.17 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.86 0.362 . . . . 0.0 111.308 179.876 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.72 151.76 43.05 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.396 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.16 -23.47 73.05 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.286 1.991 . . . . 0.0 112.294 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.91 -5.52 53.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.45 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.69 5.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.928 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 389' ' ' LEU . . . . . 0.477 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.595 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 390' ' ' LEU . . . . . 0.557 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.62 -15.69 5.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.605 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.3 148.83 23.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.606 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -73.64 -30.23 62.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.16 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.33 -47.61 26.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.997 0.427 . . . . 0.0 110.833 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.59 -44.23 91.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.841 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.37 -59.43 4.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.181 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -27.25 61.5 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.196 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.2 -41.05 67.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.401 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 398' ' ' ILE . . . . . 0.496 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.83 -53.65 16.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.542 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 399' ' ' VAL . . . . . 0.62 HG22 HD12 ' B' ' 417' ' ' ILE . 59.7 t -53.32 -46.91 58.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.817 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.5 -59.94 3.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.526 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.67 -57.14 11.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.369 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.13 -32.88 15.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.303 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 403' ' ' ARG . . . . . 0.46 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.19 -57.36 4.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.751 0.31 . . . . 0.0 111.166 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.92 -33.66 64.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.171 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 405' ' ' GLU . . . . . 0.552 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.43 -47.1 44.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.83 -23.96 67.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.13 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.14 30.28 1.12 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.932 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.08 -17.06 12.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.74 -15.45 14.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.558 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.19 -139.45 4.15 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.573 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.24 132.46 56.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.697 0.284 . . . . 0.0 111.113 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 412' ' ' VAL . . . . . 0.424 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.39 115.48 48.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.012 0.434 . . . . 0.0 110.543 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 413' ' ' LYS . . . . . 0.703 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.6 -61.96 2.06 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.248 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.04 -169.43 3.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.103 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 415' ' ' ILE . . . . . 0.616 HG23 HG12 ' B' ' 434' ' ' VAL . 48.3 mt -145.05 128.96 12.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.849 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 416' ' ' GLU . . . . . 0.422 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.91 108.84 18.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.702 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 417' ' ' ILE . . . . . 1.0 HG23 HG21 ' B' ' 432' ' ' ILE . 60.7 mt -128.52 108.62 19.07 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.637 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 418' ' ' PRO . . . . . 0.629 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.49 147.56 9.0 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.709 2.273 . . . . 0.0 112.87 -179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 419' ' ' ARG . . . . . 0.557 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.89 74.64 21.97 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.194 179.875 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -47.14 117.04 1.99 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.739 2.293 . . . . 0.0 112.504 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 421' ' ' VAL . . . . . 0.598 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.7 t -74.28 97.8 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.22 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.57 21.74 8.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.482 0.658 . . . . 0.0 109.348 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 423' ' ' GLY . . . . . 0.645 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.4 29.21 6.07 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.263 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 424' ' ' VAL . . . . . 0.598 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.45 -37.59 30.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.119 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.83 35.9 4.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.844 0.355 . . . . 0.0 111.849 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 426' ' ' VAL . . . . . 0.675 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.22 -44.75 49.35 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.839 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 427' ' ' PRO . . . . . 0.675 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.1 Cg_endo -66.33 77.16 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.537 2.158 . . . . 0.0 111.018 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.21 -15.43 3.23 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.367 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.5 149.37 50.26 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.615 0.245 . . . . 0.0 110.79 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.15 5.06 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.838 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.52 126.1 44.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.899 0.38 . . . . 0.0 111.0 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 432' ' ' ILE . . . . . 1.0 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -130.98 172.92 15.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.256 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 433' ' ' PHE . . . . . 0.609 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.34 2.79 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.954 -178.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 434' ' ' VAL . . . . . 0.616 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.85 141.73 41.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.188 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 435' ' ' GLU . . . . . 0.485 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.41 108.53 17.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.752 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.83 168.39 12.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.256 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 437' ' ' THR . . . . . 0.703 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -94.97 -45.4 7.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.451 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.87 146.67 52.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.07 0.462 . . . . 0.0 111.26 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.21 -12.77 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.165 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.62 -54.8 26.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.09 0.471 . . . . 0.0 110.096 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.14 -29.52 60.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.818 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.22 -31.68 72.26 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.22 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -78.66 -48.0 15.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.682 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.62 -12.03 59.52 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.738 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -55.28 3.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.949 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 446' ' ' MET . . . . . 0.626 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.2 OUTLIER -64.83 -26.6 68.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.199 -179.313 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.16 -16.2 63.06 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.588 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.62 -8.63 22.52 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.354 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 449' ' ' LEU . . . . . 0.403 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.3 mt -95.69 -20.76 18.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.726 0.298 . . . . 0.0 110.898 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 15.8 p -73.95 126.73 31.1 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.063 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 98.35 -9.06 62.77 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.978 178.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 452' ' ' ARG . . . . . 0.419 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -76.59 -152.21 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.787 0.293 . . . . 0.0 110.505 177.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 453' ' ' LYS . . . . . 0.475 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.1 2.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.768 0.318 . . . . 0.0 111.296 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.35 -36.29 75.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.515 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.26 -50.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -157.3 24.86 0.3 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.779 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 457' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.52 135.74 19.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.316 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 13.4 p -59.41 126.94 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 121.273 0.559 . . . . 0.0 111.034 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 459' ' ' VAL . . . . . 0.812 HG12 ' HB3' ' B' ' 383' ' ' MET . 3.7 m -84.86 127.82 39.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.844 -176.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 460' ' ' VAL . . . . . 0.544 ' HA ' ' CB ' ' A' ' 38' ' ' THR . 47.0 t -95.45 92.55 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.063 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 67.5 p -100.25 128.01 46.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.907 0.384 . . . . 0.0 111.316 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 462' ' ' LYS . . . . . 0.823 ' HG2' ' H ' ' A' ' 40' ' ' ILE . 11.7 mtmt -132.02 -159.67 0.98 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.038 -178.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -113.32 147.02 38.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.53 -179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 464' ' ' CYS . . . . . 0.561 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.88 149.0 47.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.049 0.452 . . . . 0.0 111.311 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 465' ' ' ASP . . . . . 0.46 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.33 129.34 66.86 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.405 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 466' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.09 -33.21 72.88 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.708 2.272 . . . . 0.0 112.095 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.06 -58.55 7.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.37 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.33 -33.81 68.11 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.291 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 469' ' ' TYR . . . . . 0.485 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.5 t80 -60.12 -51.18 70.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.162 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.42 -47.5 69.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.326 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 471' ' ' ARG . . . . . 0.455 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.17 49.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.39 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.11 20.8 8.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.888 0.375 . . . . 0.0 110.215 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 473' ' ' ASP . . . . . 0.455 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.72 -20.94 24.56 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.978 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -87.47 75.45 9.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.23 0.538 . . . . 0.0 110.541 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 3.3 p-90 . . . . . 0 C--O 1.246 0.917 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.397 178.391 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.9 mtp . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.803 0.335 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -117.27 -29.07 5.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.462 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 11.4 t -145.42 160.95 40.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.801 0.334 . . . . 0.0 111.324 -177.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.81 -0.01 86.16 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.632 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -73.69 147.77 43.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.771 0.32 . . . . 0.0 110.948 178.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -85.77 89.95 7.9 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.032 0.444 . . . . 0.0 111.578 -177.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.99 -28.61 18.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.025 174.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.473 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 30.2 p -93.66 127.32 46.37 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.637 176.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 16.2 Cg_exo -69.02 162.85 39.98 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.131 2.554 . . . . 0.0 112.709 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.417 ' HA ' HD13 ' A' ' 10' ' ' LEU . 3.6 mm? -63.96 -24.81 67.86 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.096 176.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -83.41 125.84 32.11 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.733 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -100.96 155.24 36.54 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.545 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.77 115.49 2.52 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.664 2.243 . . . . 0.0 112.384 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.98 -166.76 1.33 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.904 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.34 51.97 12.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.41 -36.15 3.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.002 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.79 91.85 2.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.863 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.93 -54.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.799 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.87 111.13 13.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.005 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.93 125.69 25.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.735 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.67 12.73 19.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.961 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.612 ' HZ3' HG11 ' B' ' 459' ' ' VAL . 71.6 m95 -141.97 52.97 1.48 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.766 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.15 -156.59 0.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.928 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.478 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.3 -37.65 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.76 121.26 42.76 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 118.951 -0.547 . . . . 0.0 110.64 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.599 ' HB ' ' HA3' ' A' ' 71' ' ' GLY . 59.3 p -118.25 175.88 5.49 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 123.266 0.353 . . . . 0.0 110.904 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.475 ' HB3' ' H ' ' A' ' 28' ' ' GLU . 4.8 tpt 53.17 -96.86 0.06 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.698 0.623 . . . . 0.0 112.323 176.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.475 ' H ' ' HB3' ' A' ' 27' ' ' MET . 18.3 mt-10 -97.48 135.32 39.51 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.273 -178.249 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -97.72 99.83 11.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.154 175.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -111.85 -67.13 1.02 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.633 -176.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.9 t -125.35 138.88 54.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.238 0.542 . . . . 0.0 111.901 -176.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -112.97 94.1 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.844 175.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.95 123.35 30.31 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 121.297 0.57 . . . . 0.0 111.398 -176.054 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -78.11 118.21 4.32 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.691 2.26 . . . . 0.0 112.596 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 161.27 56.21 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.935 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.1 ptm -134.72 74.16 65.47 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.08 0.467 . . . . 0.0 110.749 177.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -81.41 142.46 13.21 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 123.215 2.61 . . . . 0.0 112.265 -178.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.593 ' HB ' HG22 ' B' ' 460' ' ' VAL . 15.4 p -115.84 -25.04 7.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.979 -178.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 22.1 m -60.69 125.98 17.77 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-O 121.388 0.613 . . . . 0.0 111.659 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.536 HD11 HG13 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -79.39 132.87 61.1 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.992 -177.939 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' A' ' 42' ' ' PRO . 54.5 Cg_endo -71.49 132.88 21.36 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.024 2.483 . . . . 0.0 112.744 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 29.8 Cg_exo -62.0 125.75 17.22 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.965 2.444 . . . . 0.0 112.642 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 114.45 50.98 0.48 Allowed Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.575 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.447 HD22 ' O ' ' A' ' 41' ' ' PRO . 1.5 pt? -152.45 -169.01 3.22 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.72 0.295 . . . . 0.0 110.968 -179.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.596 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 40.3 p -119.35 170.04 9.47 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.493 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.526 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.0 -31.32 71.68 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.297 178.74 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.596 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.32 -44.99 61.89 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.43 -33.27 72.72 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.631 -176.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.505 ' HG3' ' CD1' ' A' ' 40' ' ' ILE . 22.4 tt0 -57.8 -48.23 80.3 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.095 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.554 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.62 -43.41 98.88 Favored 'General case' 0 C--O 1.186 -2.285 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.236 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.546 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.44 -40.08 81.57 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.782 0.676 . . . . 0.0 111.557 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -67.57 -45.79 74.55 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.021 175.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.606 HG23 HG21 ' B' ' 460' ' ' VAL . 95.8 mt -61.68 -49.14 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 177.203 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 50' ' ' ARG . 34.9 m -67.51 -35.54 73.55 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.776 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.916 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.15 -44.58 92.09 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.568 0.622 . . . . 0.0 110.319 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.5 tp -65.29 -35.36 80.77 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.976 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -75.12 -34.6 61.71 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.656 176.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.463 HD13 HD13 ' A' ' 113' ' ' ILE . 72.8 mt -63.05 -46.91 94.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.401 0.68 . . . . 0.0 110.433 177.258 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.41 -41.39 84.94 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.668 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -67.68 -34.01 76.06 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.404 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.529 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.48 -45.02 77.12 Favored 'General case' 0 C--O 1.207 -1.181 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 174.074 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.1 m -65.43 -35.86 82.2 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.498 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.8 -42.73 76.04 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.054 0.931 . . . . 0.0 108.529 176.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.529 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.84 -47.77 83.59 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 113.833 -1.53 . . . . 0.0 111.871 179.299 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.17 -28.92 63.54 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.758 177.093 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.91 -47.16 69.53 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.498 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.09 -17.52 14.46 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.75 29.47 10.68 Favored Glycine 0 C--N 1.315 -0.605 0 C-N-CA 119.858 -1.163 . . . . 0.0 111.259 -177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.4 92.07 6.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.185 0.517 . . . . 0.0 110.165 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 18.3 tp -105.73 -50.82 3.11 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.503 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.599 ' HA3' ' HB ' ' A' ' 26' ' ' THR . . . 79.48 -96.61 1.52 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.227 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.8 pt -84.16 135.97 41.32 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.789 0.328 . . . . 0.0 110.794 177.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.97 162.57 41.1 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.794 2.33 . . . . 0.0 112.505 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.84 -2.34 10.07 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.762 2.308 . . . . 0.0 112.741 177.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -73.88 144.84 83.2 Favored Pre-proline 0 C--O 1.232 0.183 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.767 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.84 -50.53 10.13 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.049 2.499 . . . . 0.0 112.682 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -151.2 99.94 2.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.005 0.431 . . . . 0.0 110.657 178.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -100.4 108.77 20.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.083 177.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -87.79 -54.39 4.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.043 -177.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 70.3 m -134.09 141.69 40.48 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.204 -178.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 80' ' ' SER . 23.9 Cg_exo -65.68 153.69 77.06 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.215 2.61 . . . . 0.0 112.716 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 63.5 m -85.99 139.83 34.88 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.294 -178.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -80.53 173.82 11.88 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.838 2.359 . . . . 0.0 112.555 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -151.29 111.41 3.03 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.562 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -69.53 -33.45 17.41 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.764 2.309 . . . . 0.0 113.314 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 11.2 tt -106.96 127.6 62.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-O 121.201 0.524 . . . . 0.0 111.699 -178.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 37.6 p90 -103.75 149.75 24.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.467 177.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -134.3 113.16 11.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.145 0.497 . . . . 0.0 111.112 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 36.3 t -74.68 -34.49 62.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.329 176.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -126.45 124.98 41.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.541 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 169.95 23.89 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.93 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.2 mmtp -129.88 126.79 38.8 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.028 0.442 . . . . 0.0 111.25 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -136.18 -50.97 0.7 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.39 179.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 33.3 mt -101.97 146.2 28.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.759 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -86.29 160.13 19.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.271 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.2 t -168.51 -50.13 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -177.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.19 -52.43 16.55 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.329 -0.857 . . . . 0.0 109.693 -178.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.464 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.5 mp0 -53.27 -51.83 60.98 Favored 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 113.655 -1.611 . . . . 0.0 110.633 -178.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -66.67 -38.64 87.24 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.686 -177.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.96 -44.46 94.42 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 123.197 0.311 . . . . 0.0 110.385 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.711 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.9 m -69.06 -50.04 51.98 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.617 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.4 -41.28 93.82 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.95 -39.23 90.27 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 178.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.535 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.27 -40.06 89.04 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.711 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.4 mt -64.07 -40.94 97.37 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.648 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.12 -34.3 78.08 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.75 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.5 -34.39 74.23 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.4 -48.81 76.29 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.561 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.3 -45.55 94.01 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.39 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.14 -37.47 85.31 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 123.594 0.758 . . . . 0.0 111.004 -178.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.85 -43.76 86.13 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.4 mt -72.23 -38.57 68.92 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.773 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.561 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.38 -50.9 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 N-CA-C 110.514 -0.18 . . . . 0.0 110.514 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.7 m -60.71 -39.46 88.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.276 0.56 . . . . 0.0 110.551 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -68.0 -49.51 61.16 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.97 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.11 84.49 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -177.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.63 -36.85 78.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.53 -40.72 80.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.257 0.551 . . . . 0.0 110.299 177.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.5 mt -71.52 -40.6 70.0 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.982 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.64 111.23 12.47 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 116.3 -0.409 . . . . 0.0 109.929 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.78 -22.61 36.66 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.779 2.319 . . . . 0.0 112.62 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.29 0.06 55.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.409 0.623 . . . . 0.0 111.179 -177.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.91 134.64 54.42 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.606 -178.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.39 109.13 62.86 Favored Pre-proline 0 CA--C 1.509 -0.619 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.278 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.31 157.95 59.65 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.306 2.004 . . . . 0.0 111.507 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.67 154.52 25.35 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 123.589 2.859 . . . . 0.0 111.724 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.11 70.57 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -173.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -86.15 32.89 0.61 Allowed 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.765 0.666 . . . . 0.0 111.626 -177.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -86.31 149.45 25.04 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.591 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.403 ' HA ' ' HD2' ' A' ' 131' ' ' PRO . 31.6 ttpt -126.97 115.82 22.06 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 177.031 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 130' ' ' LYS . 49.6 Cg_endo -68.35 158.86 55.8 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.855 2.37 . . . . 0.0 112.1 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -56.57 -62.43 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.901 2.401 . . . . 0.0 112.216 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -125.23 -52.65 1.63 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.085 175.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 14.8 t -164.35 155.61 15.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.209 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -70.04 133.68 47.46 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.907 0.384 . . . . 0.0 110.746 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 12.8 t -69.32 127.23 30.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.142 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.411 ' HA ' HG12 ' A' ' 140' ' ' VAL . 73.2 m 61.42 46.63 7.43 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.354 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -123.46 -15.43 7.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.618 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 7.4 ttpm? -119.03 -29.94 5.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.824 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' A' ' 137' ' ' CYS . 8.4 p -79.7 143.16 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.07 -179.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 4.3 mpp? -94.41 169.84 9.92 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.272 -178.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.454 ' HB ' ' HD2' ' A' ' 143' ' ' PRO . 28.5 pt -94.43 159.84 32.99 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.155 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.454 ' HD2' ' HB ' ' A' ' 142' ' ' ILE . 27.9 Cg_endo -62.95 138.87 70.61 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.694 2.262 . . . . 0.0 112.237 178.05 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -89.47 155.76 19.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.92 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.427 -0.797 . . . . 0.0 110.986 -178.878 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.194 0 N-CA-C 112.571 -0.211 . . . . 0.0 112.571 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -122.05 101.1 42.13 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-O 120.709 0.29 . . . . 0.0 111.031 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.34 148.08 23.51 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.678 2.252 . . . . 0.0 112.696 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 375' ' ' THR . . . . . 0.463 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -129.5 -71.32 0.62 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.217 179.161 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 376' ' ' GLU . . . . . 0.495 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.93 0.01 OUTLIER 'General case' 0 C--O 1.232 0.133 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 377' ' ' VAL . . . . . 0.56 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.62 150.99 7.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.402 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 378' ' ' LEU . . . . . 0.506 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.67 152.51 20.82 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.17 -179.085 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 379' ' ' CYS . . . . . 0.584 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.53 142.53 46.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.662 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.513 HD11 HG13 ' B' ' 434' ' ' VAL . 5.4 mt -132.71 101.9 5.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.96 -179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 91.4 mtp -117.36 166.89 11.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.849 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 57.46 51.2 10.08 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 123.649 0.593 . . . . 0.0 111.273 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 383' ' ' MET . . . . . 0.438 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.83 14.4 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.228 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 384' ' ' VAL . . . . . 0.697 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.25 125.06 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.721 0.296 . . . . 0.0 111.394 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.404 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.72 151.77 43.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.431 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.23 -23.43 72.57 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.351 2.034 . . . . 0.0 112.237 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.95 -5.51 53.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.477 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.73 5.78 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.888 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 389' ' ' LEU . . . . . 0.472 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.87 34.86 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.932 0.396 . . . . 0.0 110.607 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 390' ' ' LEU . . . . . 0.544 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.51 -15.76 5.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.674 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.29 148.74 23.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.551 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -73.58 -30.27 62.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.168 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 32.8 mm-40 -75.25 -47.76 26.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.998 0.428 . . . . 0.0 110.743 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.54 -44.25 91.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.826 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.37 -59.37 5.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.214 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.29 61.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.203 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.14 -41.02 67.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.402 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 398' ' ' ILE . . . . . 0.494 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.94 -53.69 15.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.474 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 399' ' ' VAL . . . . . 0.614 HG22 HD12 ' B' ' 417' ' ' ILE . 59.5 t -53.22 -46.98 57.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.801 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.92 3.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.517 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.73 -57.16 11.84 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.331 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.1 -32.84 15.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.385 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 403' ' ' ARG . . . . . 0.451 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.27 -57.39 4.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.12 -179.945 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.92 -33.59 64.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.15 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 405' ' ' GLU . . . . . 0.535 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.41 -47.17 44.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.95 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.78 -24.0 67.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.163 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.45 1.09 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.963 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.18 -17.14 12.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.821 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.66 -15.47 14.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.489 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.42 4.15 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.571 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 411' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.24 132.52 56.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.676 0.275 . . . . 0.0 111.052 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 412' ' ' VAL . . . . . 0.423 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.45 115.41 48.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.084 0.469 . . . . 0.0 110.549 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 413' ' ' LYS . . . . . 0.673 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.61 -62.06 1.99 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.168 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.96 -169.38 3.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.167 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 415' ' ' ILE . . . . . 0.614 HG23 HG12 ' B' ' 434' ' ' VAL . 48.5 mt -145.13 128.96 12.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.831 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 416' ' ' GLU . . . . . 0.433 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.9 108.82 18.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.733 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 417' ' ' ILE . . . . . 0.974 HG23 HG21 ' B' ' 432' ' ' ILE . 60.8 mt -128.55 108.57 19.01 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.644 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 418' ' ' PRO . . . . . 0.633 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.45 147.61 8.86 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.644 2.229 . . . . 0.0 112.916 -179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 419' ' ' ARG . . . . . 0.544 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.92 74.79 21.71 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.124 179.81 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -47.25 117.06 2.04 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.729 2.286 . . . . 0.0 112.472 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 421' ' ' VAL . . . . . 0.596 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.3 t -74.4 97.86 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.12 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.55 21.71 8.92 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.582 0.706 . . . . 0.0 109.374 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 423' ' ' GLY . . . . . 0.623 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.41 29.23 6.06 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.253 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 424' ' ' VAL . . . . . 0.596 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.48 -37.57 30.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.102 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.86 35.87 4.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.798 0.332 . . . . 0.0 111.809 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 426' ' ' VAL . . . . . 0.675 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.35 -44.68 47.72 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.775 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 427' ' ' PRO . . . . . 0.675 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.27 77.09 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.532 2.155 . . . . 0.0 111.08 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.27 -15.36 3.22 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.349 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.57 149.36 50.22 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.554 0.216 . . . . 0.0 110.864 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.17 5.06 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.842 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.4 126.04 44.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.856 0.36 . . . . 0.0 111.11 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 432' ' ' ILE . . . . . 0.974 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -130.95 172.84 15.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.28 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 433' ' ' PHE . . . . . 0.584 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.43 -176.36 2.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.981 0.419 . . . . 0.0 112.027 -178.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 434' ' ' VAL . . . . . 0.614 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.79 141.76 41.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.211 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 435' ' ' GLU . . . . . 0.492 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.36 108.39 17.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.849 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.72 168.4 12.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.255 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 437' ' ' THR . . . . . 0.673 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.91 -45.44 7.28 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.455 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.87 146.59 52.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.028 0.442 . . . . 0.0 111.249 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.15 -12.74 16.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.238 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -54.79 26.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.015 0.436 . . . . 0.0 110.087 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -75.08 -29.54 60.7 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.829 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.2 -31.71 72.27 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.197 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -78.61 -48.12 15.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.666 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.55 -12.11 59.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.73 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.83 -55.34 3.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.946 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 446' ' ' MET . . . . . 0.506 ' HB3' HD21 ' B' ' 378' ' ' LEU . 3.3 ptm -65.02 -25.86 68.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.22 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.8 -16.2 62.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.606 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.62 22.55 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.418 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 449' ' ' LEU . . . . . 0.407 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.66 -19.72 19.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.818 0.342 . . . . 0.0 110.99 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 16.0 m -72.85 125.94 28.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.206 -0.907 . . . . 0.0 111.038 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 98.5 -9.12 62.48 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.946 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 452' ' ' ARG . . . . . 0.433 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.83 -152.15 0.05 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.865 0.332 . . . . 0.0 110.553 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 453' ' ' LYS . . . . . 0.478 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.13 2.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.791 0.329 . . . . 0.0 111.263 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.33 -36.33 75.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.55 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.22 -50.92 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.754 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -157.23 24.89 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.834 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 457' ' ' ARG . . . . . 0.419 ' NE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.41 132.39 16.19 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.253 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 5.6 p -66.37 112.64 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.552 0.691 . . . . 0.0 110.994 -177.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 459' ' ' VAL . . . . . 0.612 HG11 ' HZ3' ' A' ' 22' ' ' TRP . 1.9 p -73.0 124.03 29.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.736 -174.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 460' ' ' VAL . . . . . 0.606 HG21 HG23 ' A' ' 53' ' ' ILE . 66.9 t -92.55 102.53 13.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.868 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 72.8 p -92.82 153.91 18.57 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.744 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 462' ' ' LYS . . . . . 0.41 ' HE2' ' HB2' ' B' ' 462' ' ' LYS . 0.1 OUTLIER -151.75 -168.41 3.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.082 0.468 . . . . 0.0 111.266 -177.714 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.44 146.91 37.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.411 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 464' ' ' CYS . . . . . 0.56 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 148.98 47.43 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.071 0.463 . . . . 0.0 111.363 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 465' ' ' ASP . . . . . 0.463 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.32 129.32 66.96 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.377 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 466' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.3 Cg_endo -53.96 -33.32 71.95 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.708 2.272 . . . . 0.0 112.148 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.51 7.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.385 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.81 68.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.289 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 469' ' ' TYR . . . . . 0.492 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.0 -51.28 70.33 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.161 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.38 -47.51 69.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.335 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 471' ' ' ARG . . . . . 0.448 HH11 ' HD2' ' B' ' 471' ' ' ARG . 0.0 OUTLIER -81.68 -2.18 49.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.438 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.1 20.77 8.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.007 0.432 . . . . 0.0 110.282 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 473' ' ' ASP . . . . . 0.436 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.62 -21.82 29.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.96 179.835 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 49.3 p90 43.58 33.48 0.67 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.652 1.181 . . . . 0.0 112.856 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 20.5 t90 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.184 -0.913 . . . . 0.0 110.637 179.572 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.4 mmm . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.88 0.372 . . . . 0.0 110.938 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.89 -25.87 29.85 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.19 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 30.1 p 52.66 -158.6 0.13 Allowed 'General case' 0 N--CA 1.474 0.756 0 O-C-N 123.977 0.798 . . . . 0.0 112.566 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 98.23 77.84 1.36 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.62 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -99.76 52.09 0.92 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.973 0.416 . . . . 0.0 110.825 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -92.55 -42.81 9.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.106 -178.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -135.38 172.85 12.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.845 0.355 . . . . 0.0 111.536 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.432 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 25.6 m -106.35 123.6 38.37 Favored Pre-proline 0 CA--C 1.53 0.184 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.883 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 23.4 Cg_exo -64.66 151.97 83.64 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.058 2.506 . . . . 0.0 113.005 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 97.6 mt -112.82 -167.38 1.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.881 179.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -92.96 167.26 11.93 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.319 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -108.5 151.84 41.79 Favored Pre-proline 0 CA--C 1.531 0.223 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.935 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -57.29 115.49 2.54 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.993 2.462 . . . . 0.0 112.407 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.01 -166.7 1.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.836 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.31 51.96 12.22 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.935 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.43 -36.18 3.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.996 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.92 2.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.89 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.93 -54.26 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.734 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.13 13.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.57 24.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.816 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.84 19.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.038 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.602 ' HZ3' HG21 ' B' ' 459' ' ' VAL . 71.7 m95 -142.02 53.05 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.806 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.2 -156.59 0.13 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.889 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.467 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.27 -37.7 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.454 ' O ' ' HB ' ' A' ' 26' ' ' THR . 0.2 OUTLIER -114.72 125.72 54.05 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 118.826 -0.607 . . . . 0.0 110.607 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.587 ' H ' ' HA ' ' A' ' 29' ' ' GLN . 88.3 m 101.38 146.71 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 O-C-N 124.615 1.197 . . . . 0.0 110.778 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.571 ' HG2' ' HB3' ' B' ' 456' ' ' ASN . 24.2 ttt 79.43 -29.46 0.14 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.375 1.07 . . . . 0.0 110.452 -173.15 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -142.09 -26.17 0.65 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 173.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.587 ' HA ' ' H ' ' A' ' 26' ' ' THR . 0.5 OUTLIER 59.92 88.01 0.08 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.001 -1.0 . . . . 0.0 112.493 176.257 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.648 ' HG3' HH22 ' A' ' 63' ' ' ARG . 23.7 ttmm -124.3 95.76 4.66 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.48 174.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 26.9 p -66.97 -56.2 11.2 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.057 -173.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 8.4 p -90.42 140.33 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.889 0.375 . . . . 0.0 110.741 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.429 ' HB ' ' HD2' ' A' ' 34' ' ' PRO . 1.0 OUTLIER -70.35 162.63 68.76 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.128 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.429 ' HD2' ' HB ' ' A' ' 33' ' ' ILE . 78.2 Cg_exo -51.38 136.43 47.52 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.909 2.406 . . . . 0.0 112.629 178.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.86 -43.99 98.46 Favored Glycine 0 C--N 1.334 0.417 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.847 -178.017 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 70.7 mtm -109.88 150.22 41.06 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.503 0.192 . . . . 0.0 110.714 178.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -58.72 156.62 31.56 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 123.039 2.493 . . . . 0.0 112.644 178.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.505 ' HB ' HG13 ' B' ' 460' ' ' VAL . 43.3 p -99.59 -22.14 15.58 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.143 -176.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 28.4 m -59.22 129.69 21.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.799 -176.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.913 ' HB ' ' HD3' ' B' ' 462' ' ' LYS . 62.6 mt -115.44 125.85 28.38 Favored Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.827 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 42' ' ' PRO . 25.5 Cg_endo -61.19 158.74 33.52 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.696 2.93 . . . . 0.0 113.922 -175.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 1.6 Cg_endo -81.42 108.89 2.01 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 123.436 2.758 . . . . 0.0 112.849 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 136.25 28.76 0.36 Allowed Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.396 178.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -110.22 171.24 7.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.998 0.428 . . . . 0.0 111.168 -175.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.587 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 1.5 p -99.38 149.15 23.46 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.334 174.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.492 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -58.64 -31.32 68.02 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.329 -178.95 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.587 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.33 -45.18 61.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.33 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.16 -33.1 72.88 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.761 -177.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.754 ' HG2' HG21 ' A' ' 40' ' ' ILE . 51.1 mt-10 -61.24 -44.75 96.75 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.225 178.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.556 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.89 -43.39 98.93 Favored 'General case' 0 C--O 1.185 -2.316 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.248 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.553 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.26 -41.09 83.5 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 123.789 0.681 . . . . 0.0 111.626 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.79 -46.8 80.57 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.024 175.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.603 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 96.5 mt -64.49 -46.94 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.013 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 50' ' ' ARG . 34.9 m -68.04 -35.59 72.3 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.806 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.914 -177.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.12 -44.22 91.98 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.515 0.598 . . . . 0.0 110.349 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 1.7 pp -70.17 -28.55 65.42 Favored 'General case' 0 C--N 1.344 0.367 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.713 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.472 HE21 ' HA ' ' A' ' 54' ' ' VAL . 23.2 mt-30 -77.86 -34.68 51.64 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 120.873 0.368 . . . . 0.0 110.167 176.351 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.483 HD13 HD13 ' A' ' 113' ' ' ILE . 72.5 mt -62.9 -46.94 95.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.382 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.463 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.48 -41.28 84.84 Favored 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.703 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -68.31 -33.35 74.16 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.199 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.531 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.47 -44.98 77.28 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 173.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 m -65.63 -35.61 81.29 Favored 'General case' 0 N--CA 1.433 -1.305 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -178.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.648 HH22 ' HG3' ' A' ' 30' ' ' LYS . 39.1 ttp180 -55.82 -42.86 76.33 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 122.068 0.937 . . . . 0.0 108.495 176.158 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.531 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.71 -47.78 83.72 Favored 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.873 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.418 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.18 -28.86 63.49 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.856 177.028 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -67.97 -47.12 69.45 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.5 14.46 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -177.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.43 10.76 Favored Glycine 0 C--N 1.316 -0.57 0 C-N-CA 119.916 -1.135 . . . . 0.0 111.295 -177.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.34 88.85 6.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.258 0.552 . . . . 0.0 110.094 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 26.5 tp -130.16 -30.96 1.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.544 176.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 116.56 -133.1 10.51 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.792 -0.718 . . . . 0.0 113.054 177.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 5.9 tt -130.03 125.59 22.05 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.939 0.4 . . . . 0.0 111.364 -176.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.2 128.31 12.83 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.505 2.137 . . . . 0.0 111.826 175.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -62.8 -49.68 5.01 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.959 2.439 . . . . 0.0 112.748 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.411 ' HA ' ' HD3' ' A' ' 76' ' ' PRO . 0.3 OUTLIER -133.41 134.92 24.41 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.271 179.854 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 75' ' ' ASN . 10.0 Cg_exo -72.0 132.89 20.54 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.835 2.356 . . . . 0.0 111.958 176.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.79 137.34 45.74 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.991 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.07 140.28 54.86 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.056 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 -86.11 153.14 22.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.576 -178.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.0 p -144.33 136.74 13.36 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 177.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -62.38 129.23 26.06 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.452 2.102 . . . . 0.0 112.212 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.8 m -139.77 104.9 6.89 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.256 -177.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -79.24 -179.56 5.53 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 123.335 2.69 . . . . 0.0 112.458 177.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 85' ' ' PRO . 22.6 mm-40 -101.69 145.71 30.95 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 178.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 84' ' ' GLU . 32.0 Cg_exo -60.09 -39.2 71.82 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.998 2.465 . . . . 0.0 112.346 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 7.3 pt -109.86 166.41 5.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.917 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -92.15 101.17 13.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.108 175.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -105.08 143.55 33.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.716 -176.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 56.9 m -75.34 -24.45 57.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.809 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -82.91 161.97 21.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.973 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 126.75 59.81 0.14 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.755 178.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -102.81 -55.56 2.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.754 0.311 . . . . 0.0 110.583 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -98.6 84.74 3.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.161 0.505 . . . . 0.0 110.186 175.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.1 mt -91.37 131.02 37.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.272 -176.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -118.13 159.78 22.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.185 178.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.1 t -157.8 -50.11 0.07 Allowed 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.787 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.16 -52.52 16.21 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.247 -0.908 . . . . 0.0 109.692 -178.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.452 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.6 mp0 -53.3 -51.67 61.58 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.614 -1.63 . . . . 0.0 110.714 -178.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -66.78 -38.56 86.8 Favored 'General case' 0 N--CA 1.427 -1.59 0 CA-C-N 113.42 -1.718 . . . . 0.0 110.681 -177.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.523 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.89 -44.57 94.16 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.267 0.355 . . . . 0.0 110.379 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.728 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 16.0 m -69.01 -50.01 52.67 Favored 'General case' 0 N--CA 1.428 -1.561 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.649 179.027 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.449 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.4 -41.36 93.75 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -175.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.01 -39.15 90.02 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 110.381 -0.229 . . . . 0.0 110.381 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.527 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.15 -40.17 88.96 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.728 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.93 -41.02 97.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.719 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.12 -34.39 78.28 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.707 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.31 74.2 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.51 -48.84 75.95 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 175.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.554 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.32 -45.44 94.43 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.404 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.21 -37.51 85.6 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 123.603 0.761 . . . . 0.0 110.991 -178.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.84 -43.73 86.06 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.2 mt -72.21 -38.61 68.97 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.753 177.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.554 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.39 -50.86 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 120.464 0.173 . . . . 0.0 110.544 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.3 m -60.63 -39.58 88.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.221 0.534 . . . . 0.0 110.548 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.55 61.04 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.981 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.11 84.48 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.3 t -65.49 -36.88 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.19 0.519 . . . . 0.0 109.642 176.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.61 -40.77 80.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.171 0.51 . . . . 0.0 110.26 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.2 mt -71.33 -40.69 70.58 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.069 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ASN . . . . . 0.401 ' HA ' ' HD2' ' A' ' 121' ' ' PRO . 45.6 t30 -133.53 111.14 12.57 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.323 -0.398 . . . . 0.0 109.992 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 120' ' ' ASN . 59.9 Cg_endo -68.69 -22.72 37.06 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.885 2.39 . . . . 0.0 112.57 -178.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.24 0.04 55.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.35 0.595 . . . . 0.0 111.198 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.85 134.58 54.36 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.673 -178.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.36 109.18 62.91 Favored Pre-proline 0 CA--C 1.509 -0.615 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.308 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.29 157.97 59.52 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.247 1.965 . . . . 0.0 111.419 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.65 154.51 25.28 Favored 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 123.673 2.915 . . . . 0.0 111.737 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.31 69.38 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -173.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -85.45 34.11 0.57 Allowed 'General case' 0 CA--C 1.532 0.288 0 O-C-N 123.603 0.564 . . . . 0.0 111.224 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -93.34 129.2 39.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.52 177.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -114.01 128.26 25.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.493 177.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -66.75 160.21 47.61 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.917 2.411 . . . . 0.0 112.293 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.96 -0.82 9.58 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.76 2.306 . . . . 0.0 113.267 178.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -88.11 139.79 30.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.881 0.372 . . . . 0.0 111.205 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 11.1 t -89.43 158.21 17.83 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.089 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 20.2 ttm180 -98.77 139.94 33.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.967 -178.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 16.4 m -98.86 -175.94 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.23 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 53.0 t -123.85 -62.68 1.28 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.458 -178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -70.65 130.17 41.09 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.156 -177.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.401 ' HD2' ' HA ' ' A' ' 139' ' ' LYS . 20.1 tptm 59.96 89.35 0.07 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.728 0.643 . . . . 0.0 111.462 -178.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 5.9 m -76.46 137.87 21.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.194 179.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 51.9 ttm -93.6 147.52 22.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.757 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 36.0 mt -67.37 117.14 43.95 Favored Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.785 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -69.8 148.77 65.53 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.987 2.458 . . . . 0.0 112.557 -177.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -91.24 102.02 14.73 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.561 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 20.5 t70 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.18 -0.914 . . . . 0.0 111.01 -179.437 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -113.36 117.81 44.7 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.631 0.253 . . . . 0.0 111.105 -178.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.26 157.81 33.43 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.83 2.354 . . . . 0.0 111.756 174.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 375' ' ' THR . . . . . 0.452 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -119.67 -71.33 0.74 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.124 177.903 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 376' ' ' GLU . . . . . 0.49 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.88 -45.96 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 377' ' ' VAL . . . . . 0.564 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.66 150.98 7.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.431 -179.411 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 378' ' ' LEU . . . . . 0.586 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.72 152.54 20.78 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.182 -179.026 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 379' ' ' CYS . . . . . 0.605 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.52 142.6 46.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.623 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.52 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.74 101.27 5.21 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.0 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 43.3 ttm -118.02 165.58 13.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.784 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.4 t30 59.07 51.22 7.3 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 123.635 0.584 . . . . 0.0 111.273 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 383' ' ' MET . . . . . 0.694 ' HB3' HG12 ' B' ' 459' ' ' VAL . 3.0 ptm -164.89 14.4 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.233 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 384' ' ' VAL . . . . . 0.744 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.3 125.09 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 0.0 111.42 179.865 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.2 mt -110.66 151.81 43.05 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.389 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -63.26 -23.49 72.39 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.293 1.995 . . . . 0.0 112.293 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.78 -5.5 53.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.552 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -110.15 -36.69 5.77 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.9 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 389' ' ' LEU . . . . . 0.481 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.99 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.997 0.427 . . . . 0.0 110.616 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.52 -15.81 5.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.652 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -98.31 148.83 23.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.565 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -73.63 -30.16 62.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.201 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.42 -47.59 26.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.001 0.429 . . . . 0.0 110.765 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.56 -44.33 91.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.748 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.27 -59.43 4.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.245 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.06 -27.31 61.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.185 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -40.99 67.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.405 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 398' ' ' ILE . . . . . 0.495 HD13 HG12 ' B' ' 384' ' ' VAL . 65.1 mt -74.88 -53.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.505 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 399' ' ' VAL . . . . . 0.621 HG22 HD12 ' B' ' 417' ' ' ILE . 59.6 t -53.31 -46.98 57.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.775 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.94 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.756 0.312 . . . . 0.0 111.548 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.65 -57.25 11.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.288 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.04 -32.9 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.391 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 403' ' ' ARG . . . . . 0.446 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.21 -57.31 4.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.824 0.345 . . . . 0.0 111.214 -179.989 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.95 -33.64 64.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.122 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 405' ' ' GLU . . . . . 0.55 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.53 -47.05 43.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.919 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.87 -23.97 67.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.148 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.07 30.41 1.09 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.981 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.15 -17.11 12.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -106.7 -15.48 14.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.535 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.37 4.12 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.627 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 411' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.26 132.51 56.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.612 0.244 . . . . 0.0 111.083 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 412' ' ' VAL . . . . . 0.422 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.51 115.47 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.101 0.477 . . . . 0.0 110.532 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 413' ' ' LYS . . . . . 0.7 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.8 mttt -56.6 -61.93 2.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.239 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.9 p -153.05 -169.38 3.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.171 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 415' ' ' ILE . . . . . 0.614 HG23 HG12 ' B' ' 434' ' ' VAL . 48.5 mt -145.12 128.96 12.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.848 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 416' ' ' GLU . . . . . 0.421 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.91 108.77 18.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.68 179.792 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 417' ' ' ILE . . . . . 1.006 HG23 HG21 ' B' ' 432' ' ' ILE . 60.7 mt -128.51 108.63 19.09 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.663 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 418' ' ' PRO . . . . . 0.637 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.61 147.7 9.2 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.587 2.191 . . . . 0.0 112.919 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.92 74.67 21.85 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.13 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -47.08 117.11 2.02 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.752 2.302 . . . . 0.0 112.407 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 421' ' ' VAL . . . . . 0.602 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.6 t -74.43 97.84 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.942 0.401 . . . . 0.0 111.2 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.51 21.85 9.01 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.49 0.662 . . . . 0.0 109.321 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 423' ' ' GLY . . . . . 0.649 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.28 29.26 6.09 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-N 114.755 -1.111 . . . . 0.0 111.346 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 424' ' ' VAL . . . . . 0.602 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.41 -37.6 31.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.84 35.86 4.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.817 0.342 . . . . 0.0 111.805 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 426' ' ' VAL . . . . . 0.671 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.37 -44.72 47.55 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.755 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 427' ' ' PRO . . . . . 0.671 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.24 77.11 0.33 Allowed 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.5 2.134 . . . . 0.0 111.053 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.31 -15.42 3.21 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.358 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.9 t -67.64 149.39 50.12 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.519 0.199 . . . . 0.0 110.766 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.51 -14.14 5.07 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.854 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.45 126.07 44.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.774 0.321 . . . . 0.0 111.072 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 432' ' ' ILE . . . . . 1.006 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.02 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.258 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 433' ' ' PHE . . . . . 0.605 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.38 2.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.032 0.444 . . . . 0.0 111.926 -178.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 434' ' ' VAL . . . . . 0.614 HG12 HG23 ' B' ' 415' ' ' ILE . 3.2 m -135.84 141.69 41.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.207 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 435' ' ' GLU . . . . . 0.491 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.38 108.63 17.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.833 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.82 168.41 12.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.239 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 437' ' ' THR . . . . . 0.7 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.1 p -94.93 -45.39 7.29 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.519 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.84 146.66 52.25 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.057 0.456 . . . . 0.0 111.216 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.26 -12.75 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.212 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.64 -54.86 25.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.156 0.503 . . . . 0.0 110.132 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -75.1 -29.44 60.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.859 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -31.72 72.3 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.22 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -78.64 -48.07 15.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.63 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.63 -12.04 59.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.762 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -56.03 3.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.914 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 446' ' ' MET . . . . . 0.586 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.6 OUTLIER -62.88 -28.07 69.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.464 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.67 -16.18 63.31 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.598 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.65 -8.59 22.51 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.408 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 449' ' ' LEU . . . . . 0.401 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.73 -19.7 19.47 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.764 0.316 . . . . 0.0 110.915 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 4.4 t -76.78 129.32 36.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.131 0.491 . . . . 0.0 110.956 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 97.08 -10.22 65.69 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.994 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 452' ' ' ARG . . . . . 0.424 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -76.09 -152.2 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 117.081 0.44 . . . . 0.0 110.492 178.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 453' ' ' LYS . . . . . 0.467 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.84 117.06 2.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.859 0.361 . . . . 0.0 111.306 -179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.17 -36.38 75.2 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.537 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.28 -50.96 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.788 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 456' ' ' ASN . . . . . 0.571 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 4.5 p-10 -157.17 24.94 0.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.704 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 457' ' ' ARG . . . . . 0.442 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.57 135.4 18.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.244 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 14.7 p -59.86 139.06 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.666 177.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 459' ' ' VAL . . . . . 0.694 HG12 ' HB3' ' B' ' 383' ' ' MET . 14.7 m -102.18 125.85 56.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.258 0.551 . . . . 0.0 111.843 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 460' ' ' VAL . . . . . 0.599 HG21 HG23 ' A' ' 53' ' ' ILE . 77.7 t -91.65 103.01 14.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.058 175.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 35.7 p -106.77 113.12 26.42 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.053 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 462' ' ' LYS . . . . . 0.913 ' HD3' ' HB ' ' A' ' 40' ' ' ILE . 5.5 pttm -121.28 -157.33 0.72 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.343 0.592 . . . . 0.0 111.727 -178.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 463' ' ' TYR . . . . . 0.408 ' H ' ' HB2' ' B' ' 462' ' ' LYS . 1.3 m-85 -114.88 146.97 40.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.581 -172.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 464' ' ' CYS . . . . . 0.564 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.86 149.07 47.47 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.131 0.491 . . . . 0.0 111.284 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 465' ' ' ASP . . . . . 0.452 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.44 129.36 66.41 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.351 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 466' ' ' PRO . . . . . 0.49 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.3 Cg_endo -54.05 -33.32 72.96 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.763 2.309 . . . . 0.0 112.12 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.94 -58.52 7.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.445 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.41 -33.82 68.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.282 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 469' ' ' TYR . . . . . 0.491 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -59.96 -51.28 70.35 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.177 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.31 -47.55 69.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.358 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 471' ' ' ARG . . . . . 0.456 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.15 49.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.383 -179.862 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.09 20.84 8.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.917 0.389 . . . . 0.0 110.247 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 473' ' ' ASP . . . . . 0.456 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.78 -20.67 23.63 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.94 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.29 29.17 6.22 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.294 -178.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 59.0 m95 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.16 -0.924 . . . . 0.0 111.446 -179.214 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.0 mtp . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.766 0.317 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.55 124.07 31.7 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.092 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.9 t -123.38 139.31 54.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.053 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 141.02 -90.66 0.18 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.573 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -117.85 170.12 9.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.699 0.285 . . . . 0.0 111.015 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.443 ' HB3' ' H ' ' A' ' 7' ' ' ALA . 21.7 t-20 -100.28 -89.87 0.33 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.814 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.443 ' H ' ' HB3' ' A' ' 6' ' ' ASN . . . -156.7 51.47 0.5 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.051 0.453 . . . . 0.0 110.679 179.476 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.486 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.1 t -83.89 134.66 43.73 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.474 -179.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 17.1 Cg_exo -68.13 139.35 46.23 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.936 2.424 . . . . 0.0 112.218 176.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.457 ' H ' ' HG ' ' A' ' 10' ' ' LEU . 0.7 OUTLIER -83.5 161.63 21.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.094 0.474 . . . . 0.0 111.315 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -117.89 110.94 18.36 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.879 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.477 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 15.0 m-85 -81.88 131.98 55.57 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.469 176.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 39.1 Cg_exo -56.54 115.53 2.54 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.287 2.658 . . . . 0.0 112.354 -173.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.01 -166.75 1.32 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.85 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.38 51.93 12.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.41 -36.23 3.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.974 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.84 2.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.92 -54.2 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.783 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.83 111.22 13.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.03 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.57 24.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.739 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.55 12.79 19.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.995 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.545 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.7 m95 -142.05 53.05 1.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.994 0.426 . . . . 0.0 110.83 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.2 -156.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.885 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.462 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.35 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.883 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.83 124.67 52.34 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-O 118.93 -0.557 . . . . 0.0 110.57 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.534 HG21 ' HB2' ' A' ' 29' ' ' GLN . 0.2 OUTLIER -143.6 -176.27 4.89 Favored 'General case' 0 C--N 1.328 -0.364 0 O-C-N 123.872 0.732 . . . . 0.0 110.041 172.802 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.532 ' H ' HG22 ' A' ' 26' ' ' THR . 4.6 mpp? -110.28 -38.41 5.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.775 0.321 . . . . 0.0 110.742 177.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -108.9 -22.33 12.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.709 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.534 ' HB2' HG21 ' A' ' 26' ' ' THR . 22.2 mm-40 -114.58 41.48 2.33 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.319 -178.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.513 ' HB2' ' H ' ' A' ' 26' ' ' THR . 81.0 tttt -129.76 138.07 50.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.819 0.343 . . . . 0.0 111.022 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.452 ' H ' ' HZ1' ' B' ' 453' ' ' LYS . 29.4 p -126.02 -58.56 1.37 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.882 176.537 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.538 ' HA ' HH22 ' A' ' 63' ' ' ARG . 13.9 m -112.49 144.35 20.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.087 0.47 . . . . 0.0 111.87 -177.128 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.433 ' H ' HH22 ' A' ' 63' ' ' ARG . 1.0 OUTLIER -79.94 154.34 75.31 Favored Pre-proline 0 CA--C 1.53 0.176 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.861 177.325 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.11 155.77 60.77 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.732 2.288 . . . . 0.0 113.126 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.74 16.9 2.39 Favored Glycine 0 N--CA 1.452 -0.293 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.627 178.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -128.11 121.82 21.88 Favored Pre-proline 0 C--O 1.233 0.211 0 CA-C-O 120.658 0.266 . . . . 0.0 111.281 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -73.65 147.25 39.98 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.864 2.376 . . . . 0.0 111.978 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.693 ' HB ' HG13 ' B' ' 460' ' ' VAL . 55.4 p -138.14 90.84 2.51 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-O 121.138 0.494 . . . . 0.0 111.32 -175.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.1 m -142.71 133.23 23.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.714 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.855 ' H ' ' HB3' ' B' ' 462' ' ' LYS . 0.4 OUTLIER -93.98 135.56 24.61 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.533 179.164 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 40' ' ' ILE . 13.6 Cg_exo -70.62 169.11 20.78 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 123.539 2.826 . . . . 0.0 113.117 -177.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -78.27 121.12 5.14 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.649 2.233 . . . . 0.0 113.222 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 109.36 38.95 1.71 Allowed Glycine 0 C--N 1.33 0.218 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.74 176.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.493 ' HB3' ' HG3' ' A' ' 49' ' ' GLU . 3.8 mm? -113.58 129.54 56.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.769 0.318 . . . . 0.0 111.077 -173.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 54.7 p -79.19 159.07 27.53 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.506 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.11 -31.32 71.01 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 120.878 0.37 . . . . 0.0 111.305 -175.025 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -72.27 -45.12 61.48 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.3 -33.28 72.93 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.695 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.571 ' HG2' HG12 ' A' ' 40' ' ' ILE . 35.6 mt-10 -60.56 -45.21 94.75 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.145 177.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.556 ' O ' HG22 ' A' ' 54' ' ' VAL . 16.0 mmt180 -62.81 -43.32 99.11 Favored 'General case' 0 C--O 1.185 -2.327 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.211 177.501 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.541 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.42 -41.44 85.03 Favored 'General case' 0 C--N 1.32 -0.699 0 O-C-N 123.78 0.675 . . . . 0.0 111.632 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -65.3 -44.76 86.88 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.842 177.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.689 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 92.2 mt -69.18 -44.83 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.309 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.1 m -67.05 -35.49 74.66 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.71 0 CA-C-O 118.656 -0.688 . . . . 0.0 111.873 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.18 -44.77 92.17 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.595 0.634 . . . . 0.0 110.335 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 3.3 pp -72.12 -23.17 61.28 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.125 -178.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.409 HE21 HG22 ' A' ' 53' ' ' ILE . 40.9 mt-30 -85.86 -30.67 22.73 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.199 175.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.469 HD13 HD13 ' A' ' 113' ' ' ILE . 73.2 mt -62.59 -47.01 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.07 0.548 . . . . 0.0 110.411 172.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.483 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.34 -41.72 84.75 Favored 'General case' 0 CA--C 1.512 -0.482 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.667 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -68.53 -32.82 73.04 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.37 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.538 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.37 -45.1 77.27 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 173.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 m -65.47 -35.76 81.87 Favored 'General case' 0 N--CA 1.433 -1.288 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.538 HH22 ' HA ' ' A' ' 32' ' ' VAL . 39.2 ttp180 -55.73 -42.82 75.92 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.0 ttmt -61.83 -47.68 84.01 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.798 -1.546 . . . . 0.0 111.913 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.21 -28.86 63.45 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 119.758 -0.777 . . . . 0.0 111.888 176.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.92 -47.25 69.27 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.499 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.11 -17.51 14.46 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.926 -0.709 . . . . 0.0 112.904 -177.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.75 29.49 10.67 Favored Glycine 0 C--N 1.316 -0.528 0 C-N-CA 119.887 -1.149 . . . . 0.0 111.307 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.42 93.16 7.16 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.244 0.545 . . . . 0.0 110.261 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 23.3 tp -112.82 -39.42 4.28 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.68 178.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -151.19 -113.42 0.59 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.59 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 29.2 pt -85.74 153.95 58.35 Favored Pre-proline 0 CA--C 1.53 0.192 0 CA-C-O 120.796 0.331 . . . . 0.0 111.538 -178.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.419 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 55.2 Cg_endo -70.77 156.02 61.5 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.864 2.376 . . . . 0.0 112.368 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 73' ' ' PRO . 31.9 Cg_exo -60.13 133.06 47.7 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.935 2.423 . . . . 0.0 112.837 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.427 ' HA ' ' HD3' ' A' ' 76' ' ' PRO . 90.8 m-20 -91.33 141.39 26.08 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.987 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 75' ' ' ASN . 6.0 Cg_exo -80.42 76.59 4.45 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.3 2.667 . . . . 0.0 112.46 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -160.53 -60.12 0.06 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.567 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -121.15 121.38 37.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.699 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -106.03 -63.23 1.28 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.424 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.467 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 67.1 m -128.5 109.87 19.19 Favored Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.82 179.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 80' ' ' SER . 2.7 Cg_exo -76.6 149.62 30.6 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.334 2.689 . . . . 0.0 112.645 -178.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 45.7 t -136.5 120.33 12.4 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.797 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -68.94 163.79 36.17 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.98 2.454 . . . . 0.0 112.684 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.752 ' HB3' ' HD3' ' A' ' 85' ' ' PRO . 38.9 tt0 -69.03 -54.34 12.32 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.549 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.752 ' HD3' ' HB3' ' A' ' 84' ' ' GLU . 9.8 Cg_exo -72.6 173.81 12.7 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 122.369 2.046 . . . . 0.0 112.256 177.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 17.8 tt -78.44 137.05 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.091 0.472 . . . . 0.0 110.966 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -75.64 133.84 40.76 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.724 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -80.22 133.82 36.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.015 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 35.0 t -74.55 -45.76 43.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.781 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 63.72 -91.27 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.97 0.794 . . . . 0.0 111.505 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -172.57 38.25 0.15 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.434 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -86.34 -59.65 2.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.335 0.112 . . . . 0.0 110.862 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 33.1 ttm180 71.91 -76.36 0.07 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 124.152 0.907 . . . . 0.0 112.351 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 88.3 mt -91.92 -162.86 0.97 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.888 0.375 . . . . 0.0 111.758 -176.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -74.88 147.53 40.97 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.349 0.595 . . . . 0.0 112.191 -176.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -140.22 -50.02 0.47 Allowed 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.737 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.19 -52.56 15.98 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.273 -0.892 . . . . 0.0 109.598 -178.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.447 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.6 mp0 -53.27 -51.75 61.27 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-N 113.616 -1.629 . . . . 0.0 110.614 -178.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.77 -38.61 86.92 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.482 -1.69 . . . . 0.0 110.626 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.53 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.92 -44.6 94.21 Favored 'General case' 0 CA--C 1.51 -0.563 0 O-C-N 123.182 0.302 . . . . 0.0 110.38 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.719 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.6 m -68.95 -50.03 52.8 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.679 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.455 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.37 -41.32 93.91 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 -175.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.97 -39.24 90.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.595 0.236 . . . . 0.0 110.373 178.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.534 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.17 -40.19 89.07 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.89 -41.08 97.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.7 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.06 -34.32 78.13 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.734 178.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.39 74.31 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 177.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.46 -48.8 76.21 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 175.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.552 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.23 -45.59 93.92 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.405 179.025 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.26 -37.41 85.35 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 123.579 0.751 . . . . 0.0 111.019 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.79 -43.81 85.85 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 177.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.5 mt -72.17 -38.67 69.07 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.157 -0.928 . . . . 0.0 110.75 177.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.35 -50.88 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 N-CA-C 110.488 -0.19 . . . . 0.0 110.488 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 96.0 m -60.79 -39.44 88.9 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.272 0.558 . . . . 0.0 110.589 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.614 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.88 -49.55 61.39 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.063 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.4 -37.11 84.51 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -177.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.1 t -65.57 -36.81 78.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.63 -40.78 80.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.206 0.527 . . . . 0.0 110.231 177.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.2 mt -71.4 -40.65 70.39 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.019 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ASN . . . . . 0.403 ' HA ' ' HD2' ' A' ' 121' ' ' PRO . 45.4 t30 -133.57 111.22 12.54 Favored Pre-proline 0 C--N 1.317 -0.834 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 120' ' ' ASN . 59.9 Cg_endo -68.79 -22.66 36.55 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.765 2.31 . . . . 0.0 112.531 -178.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.24 0.06 55.95 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.353 0.596 . . . . 0.0 111.175 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.91 134.64 54.42 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.61 -178.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.43 109.21 62.95 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.251 177.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.26 157.89 59.86 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.305 2.004 . . . . 0.0 111.516 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.57 154.5 24.88 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 123.603 2.869 . . . . 0.0 111.809 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.16 -28.59 67.42 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -173.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -71.61 -12.36 61.31 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -164.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -138.42 115.31 10.79 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.187 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -94.5 129.11 37.65 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.254 178.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.518 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 34.5 Cg_exo -59.57 139.05 87.25 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.897 2.398 . . . . 0.0 112.583 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.518 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 16.4 Cg_exo -68.73 -10.63 29.65 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.271 2.647 . . . . 0.0 112.793 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -79.65 -15.3 57.84 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.987 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 15.5 m -84.8 105.06 15.3 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -95.51 110.33 22.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.164 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 2.9 m -104.01 117.54 49.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.07 178.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 42.9 t -114.85 145.91 41.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.833 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -131.82 150.22 52.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.035 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -106.43 85.33 2.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.324 177.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 12.0 p -89.97 138.29 19.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.212 -177.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 47.2 ttm -97.12 133.86 41.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.5 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.496 HG13 ' HD2' ' A' ' 143' ' ' PRO . 8.8 tt -79.6 130.42 67.98 Favored Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.821 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.496 ' HD2' HG13 ' A' ' 142' ' ' ILE . 18.9 Cg_endo -60.67 143.58 99.43 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.93 2.42 . . . . 0.0 112.871 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -84.78 156.13 21.52 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.035 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 . . . . . 0 C--O 1.251 1.147 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.503 -179.853 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.156 0 N-CA-C 112.417 -0.273 . . . . 0.0 112.417 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 65.42 103.69 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.497 0 C-N-CA 123.15 0.58 . . . . 0.0 111.73 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -83.8 155.22 13.49 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.911 2.407 . . . . 0.0 112.363 176.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 375' ' ' THR . . . . . 0.456 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -127.5 -71.23 0.67 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.123 175.253 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 376' ' ' GLU . . . . . 0.481 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.85 -45.98 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 377' ' ' VAL . . . . . 0.558 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.99 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.465 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 378' ' ' LEU . . . . . 0.594 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.61 152.51 20.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.233 -179.057 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 379' ' ' CYS . . . . . 0.613 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.55 142.59 46.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.629 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.522 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.76 101.72 5.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.91 0.385 . . . . 0.0 110.958 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 85.3 mtp -119.12 166.43 12.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.97 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.7 51.26 7.88 Favored 'General case' 0 C--O 1.232 0.133 0 O-C-N 123.821 0.7 . . . . 0.0 111.345 -178.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 383' ' ' MET . . . . . 0.441 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.88 14.41 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.237 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 384' ' ' VAL . . . . . 0.739 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.3 125.01 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.382 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.413 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.61 151.78 43.01 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.468 179.425 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.2 -23.4 72.77 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.323 2.015 . . . . 0.0 112.279 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.9 -5.53 53.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.526 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.13 -36.71 5.77 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.848 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 389' ' ' LEU . . . . . 0.486 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.99 34.95 0.46 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.008 0.432 . . . . 0.0 110.669 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 390' ' ' LEU . . . . . 0.549 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.53 -15.72 5.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.693 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -98.34 148.77 23.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.553 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -73.55 -30.29 62.97 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.203 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -75.38 -47.58 26.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.768 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.63 -44.21 91.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.802 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.37 -59.47 4.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.193 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -27.32 61.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.234 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.17 -40.99 67.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.471 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 398' ' ' ILE . . . . . 0.489 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.91 -53.61 16.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.539 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 399' ' ' VAL . . . . . 0.613 HG22 HD12 ' B' ' 417' ' ' ILE . 59.3 t -53.4 -46.84 58.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.801 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.51 -59.94 3.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.52 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.68 -57.08 12.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.441 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.14 -32.86 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.346 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 403' ' ' ARG . . . . . 0.451 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.22 -57.42 4.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.766 0.317 . . . . 0.0 111.113 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.96 -33.68 64.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.127 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 405' ' ' GLU . . . . . 0.545 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 22.0 mm-40 -73.39 -47.02 45.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.981 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.85 -23.98 67.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.187 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.14 30.37 1.11 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.932 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.09 -17.12 12.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.45 14.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.493 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.17 -139.4 4.14 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.61 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 411' ' ' LEU . . . . . 0.409 ' HA ' HD13 ' B' ' 411' ' ' LEU . 1.6 mm? -114.25 132.47 56.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.677 0.275 . . . . 0.0 111.07 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 412' ' ' VAL . . . . . 0.425 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.4 p -117.43 115.45 48.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.02 0.438 . . . . 0.0 110.653 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 413' ' ' LYS . . . . . 0.697 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.62 -61.97 2.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.177 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.7 p -153.07 -169.44 3.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.049 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 415' ' ' ILE . . . . . 0.615 HG23 HG12 ' B' ' 434' ' ' VAL . 48.4 mt -145.0 128.89 12.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.945 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 416' ' ' GLU . . . . . 0.419 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.84 108.79 18.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.889 0.376 . . . . 0.0 110.702 179.811 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 417' ' ' ILE . . . . . 0.966 HG23 HG21 ' B' ' 432' ' ' ILE . 60.4 mt -128.49 108.59 19.11 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.675 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 418' ' ' PRO . . . . . 0.643 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.54 147.62 9.1 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 122.669 2.246 . . . . 0.0 112.855 -179.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 419' ' ' ARG . . . . . 0.549 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.87 74.64 22.05 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.107 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.16 117.07 2.02 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.732 2.288 . . . . 0.0 112.477 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 421' ' ' VAL . . . . . 0.597 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.6 t -74.39 97.82 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.178 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.62 21.77 9.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.535 0.684 . . . . 0.0 109.298 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 423' ' ' GLY . . . . . 0.644 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.23 29.25 6.11 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.377 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 424' ' ' VAL . . . . . 0.597 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.45 -37.47 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.9 35.81 4.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.745 0.307 . . . . 0.0 111.745 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 426' ' ' VAL . . . . . 0.666 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.31 -44.69 48.1 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.792 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 427' ' ' PRO . . . . . 0.666 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.9 Cg_endo -66.25 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.491 2.128 . . . . 0.0 111.088 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.26 -15.44 3.22 Favored Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.344 -178.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.58 149.38 50.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.68 0.276 . . . . 0.0 110.771 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.13 5.06 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.845 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 431' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -125.42 126.11 44.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.836 0.351 . . . . 0.0 111.108 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 432' ' ' ILE . . . . . 0.966 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -131.06 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.231 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 433' ' ' PHE . . . . . 0.613 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.47 -176.36 2.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.982 0.42 . . . . 0.0 111.939 -178.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 434' ' ' VAL . . . . . 0.615 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.87 141.75 41.02 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.145 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 435' ' ' GLU . . . . . 0.483 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.36 108.5 17.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.845 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.76 168.29 12.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.251 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 437' ' ' THR . . . . . 0.697 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.0 p -94.86 -45.42 7.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.517 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.89 146.57 52.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.99 0.424 . . . . 0.0 111.25 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.19 -12.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.236 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -54.86 25.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.149 0.5 . . . . 0.0 110.043 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.13 -29.5 60.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.829 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.12 -31.86 72.37 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.19 179.192 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -78.61 -48.01 15.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.641 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.63 -12.02 59.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.738 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -55.73 3.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.902 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 446' ' ' MET . . . . . 0.594 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.3 OUTLIER -63.69 -27.46 69.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.25 -179.678 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.87 -16.33 63.23 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.574 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.64 22.53 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.425 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.2 mt -95.61 -19.52 19.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.784 0.326 . . . . 0.0 111.004 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 1.7 t -72.37 132.28 43.74 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.894 176.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 92.45 -9.55 75.78 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.299 178.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 452' ' ' ARG . . . . . 0.422 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.07 -152.25 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 117.313 0.556 . . . . 0.0 110.525 178.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 453' ' ' LYS . . . . . 0.462 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.8 117.1 2.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.884 0.373 . . . . 0.0 111.331 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.27 -36.32 75.33 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.549 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.833 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.19 24.91 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.731 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 457' ' ' ARG . . . . . 0.441 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.48 135.73 19.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.301 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 14.8 p -60.83 137.28 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.968 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 459' ' ' VAL . . . . . 0.402 HG12 HG23 ' B' ' 461' ' ' THR . 45.0 t -99.77 115.36 40.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.414 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 460' ' ' VAL . . . . . 0.693 HG13 ' HB ' ' A' ' 38' ' ' THR . 39.7 t -84.88 102.76 11.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.959 176.015 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 461' ' ' THR . . . . . 0.402 HG23 HG12 ' B' ' 459' ' ' VAL . 21.4 p -102.68 123.13 45.8 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.377 -177.189 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 462' ' ' LYS . . . . . 0.855 ' HB3' ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -130.56 -159.38 0.96 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.279 0.562 . . . . 0.0 111.758 -179.485 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -114.7 147.0 40.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.667 -171.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 464' ' ' CYS . . . . . 0.558 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.9 148.98 47.36 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.068 0.461 . . . . 0.0 111.382 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 465' ' ' ASP . . . . . 0.456 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.36 129.37 66.64 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.378 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 466' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.1 -33.24 73.14 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.677 2.251 . . . . 0.0 112.07 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.46 7.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.43 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.82 68.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.281 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 469' ' ' TYR . . . . . 0.483 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.03 -51.25 70.45 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.156 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -53.32 -47.52 69.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.4 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 471' ' ' ARG . . . . . 0.456 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.75 -2.06 49.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.415 -179.895 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.1 20.8 8.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.876 0.37 . . . . 0.0 110.236 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 473' ' ' ASP . . . . . 0.456 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.83 -19.85 19.58 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.927 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 66.55 24.05 10.3 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.014 0.526 . . . . 0.0 112.043 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.469 -0.776 . . . . 0.0 110.814 -179.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.1 mtt . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 120.992 0.425 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.95 -22.84 17.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.807 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.0 m -113.39 99.71 7.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.828 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -145.21 -72.74 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.979 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 63.24 -91.62 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 176.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -74.26 -72.26 0.29 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.722 0.296 . . . . 0.0 111.52 -176.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.72 166.35 10.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.012 0.434 . . . . 0.0 111.578 -177.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.442 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.6 t -85.38 137.99 36.51 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.149 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 32.8 Cg_exo -59.12 137.11 77.34 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.967 2.445 . . . . 0.0 112.226 178.566 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.461 HD23 ' HA ' ' A' ' 10' ' ' LEU . 12.1 mt -72.96 103.41 3.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.237 0.542 . . . . 0.0 111.588 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -147.19 0.44 0.71 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.652 176.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -99.35 139.55 21.01 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.807 -178.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -56.65 115.65 2.63 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 123.04 2.493 . . . . 0.0 112.205 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.0 -166.77 1.33 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.903 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.39 51.91 12.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.908 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.36 -36.18 3.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.05 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.84 91.91 2.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.87 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.89 -54.27 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.796 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.82 111.19 13.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.941 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.61 24.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.726 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.67 12.83 19.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.94 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.558 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.7 m95 -142.02 53.07 1.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.773 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.25 -156.56 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.467 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 3.0 pt20 -169.31 -37.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.857 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.64 119.65 37.48 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.518 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.64 HG22 ' H ' ' A' ' 27' ' ' MET . 0.2 OUTLIER 65.2 -166.6 0.22 Allowed 'General case' 0 CA--C 1.538 0.51 0 O-C-N 123.982 0.802 . . . . 0.0 109.854 -171.353 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.64 ' H ' HG22 ' A' ' 26' ' ' THR . 3.1 tpt -86.55 -24.29 25.52 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.673 0.273 . . . . 0.0 110.4 177.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -141.59 143.61 33.79 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.951 0.405 . . . . 0.0 111.147 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.466 ' HG3' ' H ' ' A' ' 31' ' ' THR . 5.8 tp-100 -157.88 153.79 26.88 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.378 -178.094 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -94.89 -27.72 15.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.197 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.466 ' H ' ' HG3' ' A' ' 29' ' ' GLN . 7.3 m -105.15 104.9 14.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.909 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.4 m -119.18 138.45 49.85 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-O 121.008 0.433 . . . . 0.0 111.657 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -144.54 126.5 8.11 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.083 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.95 131.61 13.38 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.606 2.204 . . . . 0.0 111.935 175.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -129.97 -94.13 0.7 Allowed Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.186 -1.006 . . . . 0.0 113.639 -175.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.493 ' HB2' HD13 ' A' ' 56' ' ' LEU . 21.7 mmt -71.81 138.79 82.75 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.878 0.371 . . . . 0.0 111.734 -174.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.55 ' HA ' ' HB ' ' B' ' 450' ' ' THR . 74.2 Cg_endo -79.17 155.34 25.64 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.991 2.461 . . . . 0.0 112.995 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.515 ' HB ' HD11 ' A' ' 53' ' ' ILE . 72.0 p -125.2 15.27 8.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.858 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.3 m -63.67 121.62 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.091 0.472 . . . . 0.0 111.472 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.845 ' H ' ' HG2' ' B' ' 462' ' ' LYS . 67.0 mt -111.92 121.37 39.8 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.245 -177.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.463 ' O ' HD23 ' A' ' 44' ' ' LEU . 48.9 Cg_endo -68.9 167.21 23.93 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 123.462 2.775 . . . . 0.0 113.23 -177.672 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.8 118.34 5.53 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.608 2.205 . . . . 0.0 113.156 178.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 124.63 41.74 0.37 Allowed Glycine 0 C--N 1.332 0.306 0 C-N-CA 121.072 -0.585 . . . . 0.0 112.342 175.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.463 HD23 ' O ' ' A' ' 41' ' ' PRO . 3.2 mm? -124.65 145.1 49.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.015 0.436 . . . . 0.0 111.659 -175.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.502 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 16.1 p -89.75 158.0 17.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.163 174.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.513 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.78 -31.43 71.63 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 120.956 0.407 . . . . 0.0 111.317 -176.107 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.502 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.27 -45.22 61.05 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -69.14 -33.03 72.8 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.796 -177.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.551 ' HG2' HG21 ' A' ' 40' ' ' ILE . 39.9 mt-10 -62.2 -42.91 99.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.419 178.241 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.555 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -64.03 -43.36 95.8 Favored 'General case' 0 C--O 1.185 -2.302 0 CA-C-O 118.803 -0.618 . . . . 0.0 110.274 176.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.56 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.35 -41.87 85.66 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 123.792 0.683 . . . . 0.0 111.583 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -65.73 -43.19 89.79 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.744 0.307 . . . . 0.0 110.999 176.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.779 ' HA ' HD23 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -73.22 -38.49 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.465 -178.708 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 51' ' ' ALA . 35.1 m -70.34 -35.52 62.93 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.788 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.881 177.62 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.13 -43.89 92.02 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.591 0.632 . . . . 0.0 110.275 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.779 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.6 OUTLIER -65.24 -34.11 77.58 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.946 178.069 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.424 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 48.8 tt0 -80.87 -29.23 35.77 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.467 HD13 HD13 ' A' ' 113' ' ' ILE . 73.0 mt -65.08 -47.06 89.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.348 174.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.4 -41.93 84.11 Favored 'General case' 0 CA--C 1.513 -0.45 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.697 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -58.84 -43.78 90.79 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 124.887 1.367 . . . . 0.0 110.843 176.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.527 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -66.01 -44.94 83.31 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.401 178.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.0 m -65.56 -35.7 81.62 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.503 ' O ' HG22 ' A' ' 67' ' ' THR . 39.3 ttp180 -55.89 -42.68 76.34 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 122.069 0.937 . . . . 0.0 108.509 176.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.527 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.84 -47.78 83.53 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.836 -1.529 . . . . 0.0 111.883 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.412 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.16 -28.91 63.54 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 119.754 -0.778 . . . . 0.0 111.791 177.069 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -68.02 -47.1 69.38 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.503 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.11 -17.59 14.43 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 120.002 -0.679 . . . . 0.0 112.821 -177.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.8 29.44 10.66 Favored Glycine 0 C--N 1.315 -0.631 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.252 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.27 92.56 6.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.174 0.511 . . . . 0.0 110.268 -179.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.437 HD11 HD21 ' A' ' 105' ' ' LEU . 3.0 mm? -113.27 29.3 8.09 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.009 -1.45 . . . . 0.0 109.884 175.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 120.68 -61.29 0.52 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.877 178.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 13.0 pt -116.07 158.36 42.76 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 120.837 0.351 . . . . 0.0 111.742 -176.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.41 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 15.6 Cg_exo -69.48 160.02 51.37 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 123.195 2.597 . . . . 0.0 112.196 176.101 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 73' ' ' PRO . 23.8 Cg_exo -64.48 131.61 30.45 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.944 2.429 . . . . 0.0 112.325 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -116.57 102.9 53.17 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.086 -179.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -83.73 -160.9 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.254 2.636 . . . . 0.0 112.375 177.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 63.12 92.07 0.07 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.565 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -118.12 142.47 47.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.038 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.412 ' O ' ' HD3' ' A' ' 81' ' ' PRO . 29.7 ttt180 -79.06 -65.9 0.94 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.534 -178.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.2 m -103.79 103.25 35.82 Favored Pre-proline 0 C--O 1.232 0.173 0 CA-C-O 120.747 0.308 . . . . 0.0 111.221 -176.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 79' ' ' ARG . 5.4 Cg_exo -79.89 139.31 13.72 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.096 2.531 . . . . 0.0 112.423 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 48.9 m -90.0 141.07 27.72 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.576 178.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.86 114.26 2.0 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.92 2.413 . . . . 0.0 112.474 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.86 160.73 35.67 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.878 -177.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.16 149.15 82.2 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.677 2.251 . . . . 0.0 112.294 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 19.8 pt -72.25 144.01 13.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.596 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -97.99 117.63 32.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.684 176.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -86.24 -174.48 5.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.575 -174.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 75.0 p -73.88 -11.99 60.53 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.642 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -70.96 -35.13 72.04 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.615 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 87.02 71.8 1.29 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.221 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 25.7 tttm -96.55 100.98 12.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.897 0.38 . . . . 0.0 111.11 -177.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -93.46 -14.64 26.47 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.632 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.2 mp -86.73 137.25 32.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.228 176.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -147.46 -83.08 0.12 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.381 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -158.32 -50.16 0.06 Allowed 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.15 -52.51 16.31 Favored 'General case' 0 C--N 1.306 -1.323 0 O-C-N 121.237 -0.914 . . . . 0.0 109.604 -178.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.4 mp0 -53.19 -51.77 61.03 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.704 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.68 -38.74 87.42 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 113.355 -1.748 . . . . 0.0 110.666 -177.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.52 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.93 -44.48 94.32 Favored 'General case' 0 CA--C 1.511 -0.537 0 O-C-N 123.17 0.294 . . . . 0.0 110.384 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.731 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.7 m -68.94 -50.13 51.96 Favored 'General case' 0 N--CA 1.429 -1.521 0 C-N-CA 120.104 -0.638 . . . . 0.0 110.644 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.41 -41.27 93.76 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -175.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.9 -39.27 90.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.588 0.232 . . . . 0.0 110.384 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.527 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.2 -40.13 88.99 Favored 'General case' 0 C--O 1.225 -0.235 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.731 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.8 mt -64.04 -40.98 97.51 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.673 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.04 -34.35 78.23 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.785 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.4 74.32 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 177.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.5 -48.82 76.04 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 175.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.547 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.21 -45.54 94.16 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.396 179.047 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.26 -37.4 85.33 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.016 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.82 -43.8 86.0 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 66.1 mt -72.19 -38.64 69.03 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.723 177.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.44 -50.77 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-O 120.474 0.178 . . . . 0.0 110.554 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.8 m -60.79 -39.49 89.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.301 0.572 . . . . 0.0 110.544 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.601 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.9 -49.63 60.88 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.015 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.35 -37.14 84.65 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -177.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.7 t -65.54 -36.83 78.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.61 -40.79 80.23 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.23 0.538 . . . . 0.0 110.213 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.5 mt -71.41 -40.69 70.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.006 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.57 111.24 12.54 Favored Pre-proline 0 C--N 1.315 -0.894 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.011 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.76 -22.7 36.69 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.836 2.357 . . . . 0.0 112.516 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.29 0.12 55.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.379 0.609 . . . . 0.0 111.203 -177.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.86 134.62 54.43 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.66 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.4 109.08 62.81 Favored Pre-proline 0 CA--C 1.509 -0.609 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.302 177.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -68.26 157.92 59.72 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.275 1.984 . . . . 0.0 111.503 178.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.58 154.5 24.89 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 123.615 2.877 . . . . 0.0 111.786 177.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.93 -30.17 69.41 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -173.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -75.96 -13.21 60.24 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 123.451 0.469 . . . . 0.0 111.748 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -61.3 134.0 56.48 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.0 0.429 . . . . 0.0 111.491 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 131' ' ' PRO . 91.0 mttt -106.39 123.13 39.81 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.883 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.478 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 4.0 Cg_exo -77.53 136.0 15.19 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 123.117 2.544 . . . . 0.0 112.311 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 7.9 Cg_exo -73.58 137.73 25.66 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 123.048 2.498 . . . . 0.0 112.482 179.115 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -118.25 116.36 26.62 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.018 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 15.3 t -108.43 3.49 23.3 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.271 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -80.64 -75.24 0.28 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.224 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 2.4 m -122.38 167.61 15.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.172 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 80.5 m -100.86 -10.77 20.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.095 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -101.68 121.9 42.9 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.96 0.41 . . . . 0.0 111.238 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 96.5 mttt 62.5 -164.6 0.25 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.068 177.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 11.3 p -120.56 150.19 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.177 -177.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 15.4 tpt -92.35 121.09 33.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.572 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 49.7 mm -109.33 119.53 48.09 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.73 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -69.52 139.2 40.48 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.005 2.47 . . . . 0.0 112.485 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -92.35 121.87 34.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.074 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.414 -0.803 . . . . 0.0 110.808 179.176 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.304 0 N-CA-C 112.283 -0.327 . . . . 0.0 112.283 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 43.3 m80 -114.57 93.95 34.64 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 120.733 0.302 . . . . 0.0 110.288 177.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -75.44 136.33 19.39 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.284 2.656 . . . . 0.0 113.846 -174.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 375' ' ' THR . . . . . 0.462 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -115.63 -71.39 0.74 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.143 173.057 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 376' ' ' GLU . . . . . 0.486 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.92 0.01 OUTLIER 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 377' ' ' VAL . . . . . 0.565 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.64 151.0 7.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.432 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 378' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.66 152.58 20.79 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.197 -179.055 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 379' ' ' CYS . . . . . 0.599 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.64 142.57 46.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.599 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.52 HD23 HG22 ' B' ' 461' ' ' THR . 5.3 mt -132.76 101.18 5.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 381' ' ' MET . . . . . 0.455 ' HB3' ' HB ' ' B' ' 460' ' ' VAL . 18.3 ttp -116.65 165.92 12.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.596 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 382' ' ' ASN . . . . . 0.493 HD21 ' NH1' ' A' ' 50' ' ' ARG . 13.3 t30 58.31 51.13 8.69 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 123.536 0.523 . . . . 0.0 111.256 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 383' ' ' MET . . . . . 0.43 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.81 14.32 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.271 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 384' ' ' VAL . . . . . 0.712 HG21 HG23 ' B' ' 432' ' ' ILE . 0.4 OUTLIER -152.3 125.13 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.829 0.347 . . . . 0.0 111.326 179.878 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.415 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.67 151.74 43.01 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.406 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.1 -23.46 73.38 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.265 1.976 . . . . 0.0 112.352 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.86 -5.53 53.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.04 -36.69 5.79 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.909 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 389' ' ' LEU . . . . . 0.473 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -83.05 34.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.946 0.403 . . . . 0.0 110.603 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 390' ' ' LEU . . . . . 0.528 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.47 -15.73 5.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.726 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -98.28 148.74 23.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.582 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -73.56 -30.34 62.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.186 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.31 -47.68 26.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.729 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.48 -44.33 91.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.801 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -56.4 -59.4 5.02 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.211 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -27.35 61.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.23 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -40.99 67.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.42 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 398' ' ' ILE . . . . . 0.496 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.9 -53.68 15.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.513 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 399' ' ' VAL . . . . . 0.628 HG22 HD12 ' B' ' 417' ' ' ILE . 59.5 t -53.34 -46.86 58.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.795 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.51 -59.92 3.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.516 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.68 -57.13 11.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.385 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.14 -32.83 15.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.375 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 403' ' ' ARG . . . . . 0.455 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.21 -57.43 4.5 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.746 0.307 . . . . 0.0 111.145 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.88 -33.64 64.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.177 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 405' ' ' GLU . . . . . 0.558 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.5 -47.02 44.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.978 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.83 -23.97 67.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.164 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.04 30.27 1.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.972 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.11 -17.07 12.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.89 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.67 -15.52 14.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.52 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.41 4.14 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.601 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 411' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.25 132.47 56.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.319 . . . . 0.0 111.086 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 412' ' ' VAL . . . . . 0.426 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.39 115.49 48.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.061 0.457 . . . . 0.0 110.593 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 413' ' ' LYS . . . . . 0.694 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.63 -61.98 2.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.184 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.9 p -152.96 -169.35 3.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.113 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 415' ' ' ILE . . . . . 0.615 HG23 HG12 ' B' ' 434' ' ' VAL . 48.8 mt -145.2 128.92 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.859 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 416' ' ' GLU . . . . . 0.437 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.8 108.8 18.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.746 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 417' ' ' ILE . . . . . 0.969 HG23 HG21 ' B' ' 432' ' ' ILE . 61.1 mt -128.53 108.59 19.03 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.643 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 418' ' ' PRO . . . . . 0.649 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.48 147.56 8.98 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.689 2.259 . . . . 0.0 112.903 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 419' ' ' ARG . . . . . 0.528 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.83 74.74 22.11 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.158 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -47.19 117.1 2.05 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.758 2.305 . . . . 0.0 112.475 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 421' ' ' VAL . . . . . 0.594 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.5 t -74.39 97.81 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.189 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.64 21.73 9.08 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.535 0.683 . . . . 0.0 109.29 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 423' ' ' GLY . . . . . 0.639 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.31 29.29 6.07 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.291 -179.047 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 424' ' ' VAL . . . . . 0.594 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.45 -37.51 30.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.17 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.85 35.78 4.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.793 0.33 . . . . 0.0 111.771 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 426' ' ' VAL . . . . . 0.675 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.32 -44.69 47.98 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.74 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 427' ' ' PRO . . . . . 0.675 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.9 Cg_endo -66.26 77.05 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.477 2.118 . . . . 0.0 111.102 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.34 -15.43 3.2 Favored Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.339 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.54 149.4 50.19 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.596 0.236 . . . . 0.0 110.729 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.5 -14.24 5.06 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.841 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.41 126.13 44.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.819 0.342 . . . . 0.0 111.024 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 432' ' ' ILE . . . . . 0.969 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.04 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.264 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 433' ' ' PHE . . . . . 0.599 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.51 -176.4 2.81 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.981 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 434' ' ' VAL . . . . . 0.615 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.73 141.74 41.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.193 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 435' ' ' GLU . . . . . 0.484 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.37 108.48 17.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.778 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.78 168.32 12.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.256 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 437' ' ' THR . . . . . 0.694 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.91 -45.34 7.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.474 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.91 146.6 52.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.004 0.431 . . . . 0.0 111.215 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.22 -12.78 16.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.215 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.54 -54.79 26.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.086 0.469 . . . . 0.0 110.189 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -75.18 -29.54 60.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.789 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 442' ' ' CYS . . . . . 0.418 ' O ' ' HG2' ' B' ' 446' ' ' MET . 0.3 OUTLIER -62.13 -31.76 72.27 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.185 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -78.68 -48.08 15.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.611 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.58 -11.99 59.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.776 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.86 -55.9 3.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.939 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 446' ' ' MET . . . . . 0.602 ' HB3' HD21 ' B' ' 378' ' ' LEU . 1.9 ptp -62.87 -29.17 70.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.142 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -68.41 -16.2 63.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.603 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.63 -8.62 22.52 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.367 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 449' ' ' LEU . . . . . 0.409 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.69 -19.65 19.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.711 0.291 . . . . 0.0 110.925 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 450' ' ' THR . . . . . 0.55 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 39.9 p -70.02 132.22 45.56 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.087 175.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.31 -9.19 78.08 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.384 176.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 452' ' ' ARG . . . . . 0.432 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.14 -152.2 0.04 OUTLIER 'General case' 0 C--O 1.232 0.153 0 CA-C-N 117.322 0.561 . . . . 0.0 110.517 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 453' ' ' LYS . . . . . 0.467 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.85 117.08 2.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.359 . . . . 0.0 111.324 -179.866 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.29 -36.36 75.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.494 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.21 -50.91 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.817 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 456' ' ' ASN . . . . . 0.526 ' HB3' ' SD ' ' A' ' 27' ' ' MET . 4.6 p-10 -157.22 24.89 0.3 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.783 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 457' ' ' ARG . . . . . 0.43 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.45 136.54 19.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.253 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 8.2 p -56.47 140.17 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.994 176.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 50.7 t -101.73 121.67 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -174.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 460' ' ' VAL . . . . . 0.744 HG22 HG12 ' A' ' 53' ' ' ILE . 33.9 t -83.33 100.41 6.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.121 175.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 461' ' ' THR . . . . . 0.52 HG22 HD23 ' B' ' 380' ' ' LEU . 8.2 p -105.62 111.55 24.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.872 0.368 . . . . 0.0 110.94 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 462' ' ' LYS . . . . . 0.845 ' HG2' ' H ' ' A' ' 40' ' ' ILE . 31.7 mtmt -117.65 -164.59 1.01 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.28 0.562 . . . . 0.0 111.271 -177.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -111.75 147.07 36.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.549 178.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 464' ' ' CYS . . . . . 0.565 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.91 148.9 47.29 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.003 0.43 . . . . 0.0 111.373 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 465' ' ' ASP . . . . . 0.462 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.35 129.43 66.41 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.366 -179.858 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 466' ' ' PRO . . . . . 0.486 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.04 -33.4 73.19 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.782 2.321 . . . . 0.0 112.035 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.99 -58.53 7.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.396 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.76 68.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.26 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 469' ' ' TYR . . . . . 0.484 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.01 -51.27 70.38 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.162 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.39 -47.54 69.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 471' ' ' ARG . . . . . 0.438 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.64 -2.16 49.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.42 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.78 8.74 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.913 0.387 . . . . 0.0 110.223 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 473' ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' B' ' 474' ' ' PHE . 0.3 OUTLIER -56.66 -20.13 19.88 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.981 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 474' ' ' PHE . . . . . 0.482 ' HB2' ' O ' ' B' ' 473' ' ' ASP . 3.3 m-30 72.92 32.67 1.34 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.331 0.652 . . . . 0.0 111.319 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 475' ' ' TRP . . . . . 0.415 ' HB2' ' SG ' ' B' ' 464' ' ' CYS . 14.0 t90 . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.626 -0.702 . . . . 0.0 111.614 178.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.7 ttm . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.785 0.326 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -91.12 102.68 15.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.162 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.1 p -123.76 -21.01 5.29 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.322 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 133.51 -20.62 4.13 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.978 -0.63 . . . . 0.0 112.012 -178.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -101.02 -42.2 6.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.799 0.333 . . . . 0.0 111.016 178.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -97.16 99.89 11.37 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.844 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -115.92 102.03 9.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.849 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.465 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 35.7 p -90.86 131.84 36.32 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.489 -178.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 5.2 Cg_exo -74.99 143.76 29.47 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.359 2.706 . . . . 0.0 112.933 -178.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 15.5 tp -117.56 134.31 55.0 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.288 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -124.47 -4.56 7.76 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -175.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -86.98 133.88 38.2 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.982 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.07 115.51 2.55 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.624 2.216 . . . . 0.0 112.378 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.05 -166.77 1.32 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.4 51.93 12.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.894 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.42 -36.19 3.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.952 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.75 91.9 2.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.9 -54.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.832 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.472 ' NH2' ' HB3' ' A' ' 74' ' ' PRO . 1.7 tpt180 -127.89 111.22 13.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.96 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.99 125.56 24.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.713 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.72 19.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.024 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TRP . . . . . 0.568 ' HZ3' HG11 ' B' ' 459' ' ' VAL . 71.8 m95 -141.97 53.09 1.48 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.798 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.2 -156.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.858 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.486 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.36 -37.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.429 ' OD1' ' HB ' ' A' ' 33' ' ' ILE . 0.2 OUTLIER -114.71 120.6 40.64 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 118.956 -0.545 . . . . 0.0 110.598 179.961 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.492 HG21 ' HA3' ' A' ' 71' ' ' GLY . 81.0 p -93.18 -23.67 18.49 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 123.63 0.581 . . . . 0.0 111.238 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -87.94 169.9 11.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.607 177.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.74 139.87 56.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.724 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -68.04 116.33 8.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.347 0.594 . . . . 0.0 111.947 -176.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.408 ' H ' ' H ' ' A' ' 31' ' ' THR . 18.1 ptpt -153.01 -14.77 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.089 176.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.408 ' H ' ' H ' ' A' ' 30' ' ' LYS . 7.7 t -134.36 158.1 44.68 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.7 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.1 p -75.01 135.7 26.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-O 121.109 0.48 . . . . 0.0 111.039 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.481 HD12 ' HD2' ' A' ' 34' ' ' PRO . 2.4 tp -104.38 118.66 56.18 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.969 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.481 ' HD2' HD12 ' A' ' 33' ' ' ILE . 9.4 Cg_exo -71.27 117.12 4.99 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.565 2.176 . . . . 0.0 111.845 175.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -113.93 87.27 0.44 Allowed Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.919 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 94.5 mmm -71.33 129.71 88.64 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 120.573 0.225 . . . . 0.0 111.451 -178.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -60.0 146.03 96.97 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.89 2.394 . . . . 0.0 111.599 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.732 ' HB ' HG13 ' B' ' 460' ' ' VAL . 71.3 p -114.07 41.37 2.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.167 0.508 . . . . 0.0 110.815 -174.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.686 HG13 HG21 ' B' ' 450' ' ' THR . 3.1 m -104.75 116.99 49.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.774 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.865 HG21 ' HG2' ' A' ' 49' ' ' GLU . 6.3 mt -95.96 131.53 28.83 Favored Pre-proline 0 CA--C 1.536 0.411 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.338 -177.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.542 ' HB2' HD23 ' A' ' 44' ' ' LEU . 51.6 Cg_exo -55.87 156.78 18.21 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.901 3.067 . . . . 0.0 113.879 -177.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 19.2 Cg_exo -67.27 -29.87 38.18 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 123.641 2.894 . . . . 0.0 114.139 -176.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -95.35 49.47 1.89 Allowed Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.505 -0.855 . . . . 0.0 112.588 -177.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.542 HD23 ' HB2' ' A' ' 41' ' ' PRO . 1.1 mm? -117.82 152.69 34.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.723 0.297 . . . . 0.0 111.358 -174.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.507 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.6 p -95.12 156.62 16.24 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.159 175.077 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.518 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.21 -31.35 71.12 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 120.889 0.376 . . . . 0.0 111.301 -174.663 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.437 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.36 -45.13 61.22 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.23 -33.05 72.69 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.731 -177.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.865 ' HG2' HG21 ' A' ' 40' ' ' ILE . 44.5 mt-10 -60.55 -45.3 94.38 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.221 177.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.552 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.05 -43.34 98.93 Favored 'General case' 0 C--O 1.185 -2.318 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.29 177.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.556 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.33 -40.77 83.01 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 123.771 0.669 . . . . 0.0 111.571 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -67.55 -46.48 72.63 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 122.175 -0.328 . . . . 0.0 110.759 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.788 HG13 HD11 ' A' ' 40' ' ' ILE . 87.2 mt -58.52 -51.16 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 110.751 176.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.556 HG22 ' HA ' ' A' ' 51' ' ' ALA . 35.0 m -66.67 -35.6 75.2 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.744 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.919 -175.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.16 -44.91 92.14 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.537 0.608 . . . . 0.0 110.312 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.487 ' HA ' ' HG2' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -70.15 -28.08 65.06 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.828 179.358 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.5 ' HB3' ' CD1' ' A' ' 112' ' ' LEU . 15.8 mt-30 -74.34 -38.49 63.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.231 174.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.481 HD13 HD13 ' A' ' 113' ' ' ILE . 72.7 mt -62.53 -47.04 94.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 114.871 -1.058 . . . . 0.0 110.374 178.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.4 -41.51 84.84 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.689 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -67.42 -34.36 77.08 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.257 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.53 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.18 -44.91 78.49 Favored 'General case' 0 C--O 1.207 -1.175 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 174.17 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 m -65.67 -35.72 81.58 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -178.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.497 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.76 -42.8 75.98 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 122.111 0.958 . . . . 0.0 108.516 176.181 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.53 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.79 -47.73 83.84 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 113.797 -1.547 . . . . 0.0 111.898 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.418 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.21 -28.89 63.47 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.812 177.077 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -68.05 -47.06 69.38 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.497 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.52 14.45 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.971 -0.692 . . . . 0.0 112.846 -177.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.74 29.44 10.74 Favored Glycine 0 C--N 1.315 -0.592 0 C-N-CA 119.87 -1.157 . . . . 0.0 111.285 -177.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.44 90.05 6.68 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.163 0.506 . . . . 0.0 110.147 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.0 tp -92.73 -54.94 3.56 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 121.692 -0.63 . . . . 0.0 112.3 -170.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.492 ' HA3' HG21 ' A' ' 26' ' ' THR . . . 61.2 97.94 0.01 OUTLIER Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.079 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.433 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 10.7 pt -81.49 128.22 70.52 Favored Pre-proline 0 C--N 1.329 -0.313 0 O-C-N 122.569 -0.371 . . . . 0.0 111.986 -178.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.449 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 29.0 Cg_exo -62.94 135.47 51.72 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.124 2.549 . . . . 0.0 112.866 178.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.472 ' HB3' ' NH2' ' A' ' 19' ' ' ARG . 21.8 Cg_exo -66.87 131.35 25.38 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.141 2.561 . . . . 0.0 112.196 177.12 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -129.57 97.96 23.63 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.993 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.59 104.52 1.16 Allowed 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 123.215 2.61 . . . . 0.0 112.229 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 68.03 158.81 0.15 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.586 0.708 . . . . 0.0 112.373 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -119.52 164.33 15.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.688 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.8 mtt180 -74.8 -51.93 12.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.253 177.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.46 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 50.5 p -95.18 122.07 60.69 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.042 174.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 80' ' ' SER . 28.6 Cg_exo -61.82 129.89 29.25 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.774 2.316 . . . . 0.0 112.471 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.7 t -145.55 101.33 4.33 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.65 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -74.95 -20.55 16.87 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.696 2.264 . . . . 0.0 112.808 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.451 ' HA ' ' HD3' ' A' ' 85' ' ' PRO . 39.5 tt0 -139.35 116.49 8.58 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.963 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 84' ' ' GLU . 10.8 Cg_exo -71.43 107.92 2.26 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.803 2.335 . . . . 0.0 112.418 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.5 mt -90.6 110.6 22.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.558 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -148.0 140.23 24.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.261 -176.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -92.54 116.3 28.88 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.673 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.9 m -74.28 -38.76 63.3 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.537 -178.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 69.95 112.3 0.05 Allowed 'General case' 0 N--CA 1.47 0.546 0 O-C-N 123.8 0.687 . . . . 0.0 111.713 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -115.51 27.74 8.24 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.522 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -76.71 -51.64 11.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.939 0.4 . . . . 0.0 110.713 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -95.59 140.84 29.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.597 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.495 HD23 ' H ' ' A' ' 94' ' ' LEU . 1.7 pt? -74.21 -22.02 59.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.124 176.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -119.35 105.44 11.3 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.049 175.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -151.83 -50.2 0.11 Allowed 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -72.12 -52.46 16.64 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.27 -0.894 . . . . 0.0 109.7 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.463 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.5 mp0 -53.23 -51.76 61.12 Favored 'General case' 0 CA--C 1.502 -0.889 0 CA-C-N 113.612 -1.631 . . . . 0.0 110.702 -178.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.69 -38.69 87.28 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 113.428 -1.714 . . . . 0.0 110.632 -177.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.529 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.95 -44.5 94.34 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 123.154 0.284 . . . . 0.0 110.369 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.718 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.3 m -68.91 -50.11 52.3 Favored 'General case' 0 N--CA 1.428 -1.538 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.677 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.451 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.41 -41.3 93.78 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -175.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.04 -39.17 89.95 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 178.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.535 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.25 -40.11 89.13 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.718 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.3 mt -63.93 -41.04 97.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.679 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.05 -34.4 78.32 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.805 178.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.48 -34.33 74.19 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 177.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.48 -48.83 76.05 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 175.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.545 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.38 -45.48 94.2 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.352 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.3 -37.4 85.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 123.53 0.732 . . . . 0.0 111.027 -178.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.83 -43.72 85.99 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.5 ' CD1' ' HB3' ' A' ' 57' ' ' GLN . 65.7 mt -72.2 -38.63 68.99 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.771 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.545 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.36 -50.86 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 CA-C-O 120.538 0.208 . . . . 0.0 110.552 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.8 m -60.72 -39.53 88.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.289 0.566 . . . . 0.0 110.529 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.608 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.54 61.12 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.024 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.34 -37.15 84.68 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -177.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.8 t -65.58 -36.83 78.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.74 80.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.245 0.545 . . . . 0.0 110.248 177.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.6 mt -71.43 -40.59 70.33 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.055 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -133.62 111.15 12.47 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.011 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.68 -22.72 37.14 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.819 2.346 . . . . 0.0 112.577 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.28 0.04 56.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.137 -177.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.89 134.64 54.44 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.627 -178.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -105.37 109.23 62.97 Favored Pre-proline 0 CA--C 1.51 -0.583 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.211 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.32 157.88 59.94 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.293 1.995 . . . . 0.0 111.553 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.63 154.51 25.14 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 123.603 2.869 . . . . 0.0 111.711 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.03 -28.46 67.41 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -173.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -73.6 -8.62 56.71 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.728 0.642 . . . . 0.0 111.868 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -68.97 131.5 45.18 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 176.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LYS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 131' ' ' PRO . 47.9 mmtm -113.47 118.19 43.89 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-O 120.767 0.318 . . . . 0.0 111.795 -176.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 130' ' ' LYS . 6.5 Cg_exo -75.16 167.6 26.54 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.286 2.657 . . . . 0.0 111.766 174.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -80.93 32.06 0.51 Allowed 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.555 2.17 . . . . 0.0 113.089 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . 65.24 -175.87 0.18 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.258 0.623 . . . . 0.0 112.163 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 2.9 m -127.04 -14.75 5.46 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.89 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 135' ' ' ARG . 44.9 mtm-85 -74.5 105.42 5.62 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.159 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 53.8 t -124.25 128.85 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.64 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 42.5 t -74.71 -69.6 0.45 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.919 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -133.84 129.87 37.1 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.582 177.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.509 ' HD3' ' H ' ' A' ' 139' ' ' LYS . 0.0 OUTLIER -127.87 -29.98 2.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.075 -179.649 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 3.0 m -104.89 121.58 56.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.001 0.429 . . . . 0.0 110.91 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 65.6 mtt -101.32 144.77 29.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.023 -178.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.419 ' HB ' ' HD2' ' A' ' 143' ' ' PRO . 43.1 pt -95.87 158.1 34.82 Favored Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.069 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' PRO . . . . . 0.419 ' HD2' ' HB ' ' A' ' 142' ' ' ILE . 32.7 Cg_endo -65.01 140.2 64.85 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.694 2.263 . . . . 0.0 112.527 178.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 59.4 tp60 -93.78 129.97 39.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.882 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 17.4 t70 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.044 -0.979 . . . . 0.0 111.177 179.919 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 CA-C-O 120.039 -0.312 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 41.7 t-80 64.28 104.22 0.03 OUTLIER Pre-proline 0 N--CA 1.47 0.55 0 C-N-CA 123.192 0.597 . . . . 0.0 111.349 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -68.74 132.8 25.85 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.924 2.416 . . . . 0.0 113.662 -177.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 375' ' ' THR . . . . . 0.464 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -117.78 -71.32 0.74 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.168 174.196 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 376' ' ' GLU . . . . . 0.49 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.88 0.01 OUTLIER 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.071 0.396 . . . . 0.0 112.071 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 377' ' ' VAL . . . . . 0.564 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.64 150.97 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.112 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.448 -179.48 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 378' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.65 152.51 20.83 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.179 -179.052 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 379' ' ' CYS . . . . . 0.603 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.49 142.5 46.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.636 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.518 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.73 101.64 5.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.897 0.379 . . . . 0.0 111.046 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 381' ' ' MET . . . . . 0.479 ' O ' HG23 ' B' ' 459' ' ' VAL . 27.0 ttp -117.97 165.13 14.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.604 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 382' ' ' ASN . . . . . 0.433 ' HA ' HD21 ' B' ' 382' ' ' ASN . 0.3 OUTLIER 58.85 51.19 7.69 Favored 'General case' 0 C--N 1.34 0.158 0 O-C-N 123.508 0.505 . . . . 0.0 111.387 -179.385 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 383' ' ' MET . . . . . 0.439 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.85 14.38 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.228 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 384' ' ' VAL . . . . . 0.71 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.29 125.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.885 0.374 . . . . 0.0 111.315 179.878 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.416 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.76 151.72 43.05 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.402 179.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.15 -23.44 73.11 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.317 2.011 . . . . 0.0 112.297 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.91 -5.49 53.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.52 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.03 -36.77 5.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.911 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 389' ' ' LEU . . . . . 0.481 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.94 34.92 0.46 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.984 0.421 . . . . 0.0 110.684 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.51 -15.7 5.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.695 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.41 148.72 23.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.521 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -73.52 -30.28 63.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.176 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.28 -47.73 26.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.69 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.58 -44.3 91.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.71 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.33 -59.39 5.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.184 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.26 61.56 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.202 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.2 -41.05 67.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.39 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 398' ' ' ILE . . . . . 0.492 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.91 -53.65 16.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.5 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 399' ' ' VAL . . . . . 0.618 HG22 HD12 ' B' ' 417' ' ' ILE . 59.8 t -53.28 -46.96 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.805 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.46 -59.97 3.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.517 -179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.64 -57.18 11.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.356 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.12 -32.83 15.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.361 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 403' ' ' ARG . . . . . 0.439 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.22 -57.38 4.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.165 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.91 -33.64 64.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.198 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 405' ' ' GLU . . . . . 0.558 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.46 -47.03 44.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.963 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.84 -24.0 67.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.154 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.04 30.34 1.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.957 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.07 -17.16 12.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.93 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.72 -15.39 14.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.503 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.13 -139.43 4.16 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.574 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.26 132.46 56.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.726 0.298 . . . . 0.0 111.079 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 412' ' ' VAL . . . . . 0.424 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.38 115.46 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.052 0.453 . . . . 0.0 110.6 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 413' ' ' LYS . . . . . 0.665 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.62 -62.04 2.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.136 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.98 -169.36 3.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.147 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 415' ' ' ILE . . . . . 0.603 HG23 HG12 ' B' ' 434' ' ' VAL . 48.2 mt -145.1 128.97 12.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.876 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 416' ' ' GLU . . . . . 0.434 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.88 108.83 18.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.674 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 417' ' ' ILE . . . . . 0.986 HG23 HG21 ' B' ' 432' ' ' ILE . 60.5 mt -128.58 108.5 18.94 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.663 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 418' ' ' PRO . . . . . 0.63 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.47 147.62 8.9 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.621 2.214 . . . . 0.0 112.886 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.91 74.74 21.82 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.141 179.841 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -47.17 117.08 2.03 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.729 2.286 . . . . 0.0 112.497 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 421' ' ' VAL . . . . . 0.598 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.0 t -74.44 97.86 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.128 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.59 21.77 9.04 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.559 0.695 . . . . 0.0 109.358 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 423' ' ' GLY . . . . . 0.618 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.25 29.31 6.09 Favored Glycine 0 N--CA 1.444 -0.819 0 CA-C-N 114.79 -1.096 . . . . 0.0 111.306 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 424' ' ' VAL . . . . . 0.598 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.51 -37.5 30.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.152 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.92 35.93 4.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.777 0.323 . . . . 0.0 111.741 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 426' ' ' VAL . . . . . 0.666 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.37 -44.68 47.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.759 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 427' ' ' PRO . . . . . 0.666 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.34 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.488 2.125 . . . . 0.0 111.05 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.3 -15.37 3.22 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.341 -178.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.54 149.31 50.31 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.649 0.261 . . . . 0.0 110.743 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.61 -14.31 5.03 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.838 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 126.06 44.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.839 0.352 . . . . 0.0 111.111 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 432' ' ' ILE . . . . . 0.986 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -130.96 172.91 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.252 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 433' ' ' PHE . . . . . 0.603 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.37 2.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.986 0.422 . . . . 0.0 111.966 -178.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 434' ' ' VAL . . . . . 0.603 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.79 141.72 41.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.179 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 435' ' ' GLU . . . . . 0.491 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.39 108.47 17.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.836 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.74 168.35 12.56 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.205 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 437' ' ' THR . . . . . 0.665 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.96 -45.36 7.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.458 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.93 146.54 52.16 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.041 0.448 . . . . 0.0 111.25 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.14 -12.8 16.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.26 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -54.89 25.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.141 0.496 . . . . 0.0 110.121 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -75.06 -29.53 60.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.858 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -31.79 72.35 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.094 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -78.63 -48.08 15.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.611 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.54 -12.1 59.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.753 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -55.69 3.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.96 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 446' ' ' MET . . . . . 0.583 ' O ' HG23 ' B' ' 450' ' ' THR . 3.6 ptm -63.74 -28.15 69.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.038 -179.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.06 -16.28 63.66 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.54 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.56 -8.62 22.64 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.487 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 449' ' ' LEU . . . . . 0.4 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.3 mt -95.73 -19.87 19.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.739 0.304 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 450' ' ' THR . . . . . 0.726 ' HB ' ' H ' ' A' ' 38' ' ' THR . 43.2 p -70.02 131.74 44.83 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.884 175.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.81 -9.46 76.74 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.531 177.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 452' ' ' ARG . . . . . 0.424 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.15 -152.16 0.04 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 117.252 0.526 . . . . 0.0 110.505 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 453' ' ' LYS . . . . . 0.486 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.84 117.01 2.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.855 0.359 . . . . 0.0 111.34 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.17 -36.41 75.26 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.538 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.817 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 456' ' ' ASN . . . . . 0.41 ' OD1' ' HG3' ' A' ' 73' ' ' PRO . 4.6 p-10 -157.32 24.84 0.3 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.817 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 457' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.46 134.58 18.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.294 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 6.6 p -66.3 129.69 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.871 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 459' ' ' VAL . . . . . 0.568 HG11 ' HZ3' ' A' ' 22' ' ' TRP . 2.0 p -94.48 122.98 46.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.521 -175.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 460' ' ' VAL . . . . . 0.742 HG21 HG23 ' A' ' 53' ' ' ILE . 41.2 t -92.53 92.91 3.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.35 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 76.7 p -83.32 142.67 30.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.301 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 462' ' ' LYS . . . . . 0.784 ' HE3' HD12 ' A' ' 40' ' ' ILE . 1.3 ttmm -139.01 -164.18 1.61 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.2 0.524 . . . . 0.0 111.337 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.73 146.95 37.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.512 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 464' ' ' CYS . . . . . 0.564 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 148.99 47.45 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.999 0.428 . . . . 0.0 111.456 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 465' ' ' ASP . . . . . 0.464 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.35 129.39 66.6 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.337 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 466' ' ' PRO . . . . . 0.49 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.12 -33.22 73.26 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.655 2.236 . . . . 0.0 112.103 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.07 -58.39 8.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.453 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.51 -33.74 68.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.233 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 469' ' ' TYR . . . . . 0.491 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.07 -51.19 70.69 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.209 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.4 -47.49 69.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.332 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 471' ' ' ARG . . . . . 0.441 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.73 -2.11 49.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.399 -179.886 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.07 20.78 8.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.905 0.383 . . . . 0.0 110.285 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 473' ' ' ASP . . . . . 0.515 ' O ' ' HB2' ' B' ' 474' ' ' PHE . 0.3 OUTLIER -56.75 -20.48 22.39 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.959 179.927 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 474' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' B' ' 473' ' ' ASP . 2.8 m-30 77.09 -67.74 0.2 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.967 0.907 . . . . 0.0 111.582 -178.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.447 -0.787 . . . . 0.0 111.0 -178.424 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 . . . . . 0 CA--C 1.527 0.074 0 N-CA-C 110.154 -0.314 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -56.66 115.57 2.57 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.998 2.465 . . . . 0.0 112.34 -177.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.73 1.32 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.833 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.88 12.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.38 -36.22 3.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.984 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.74 91.89 2.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.894 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.89 -54.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.838 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.85 111.21 13.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.973 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.02 125.58 24.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.755 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.76 19.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.009 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.544 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.9 m95 -141.97 53.02 1.48 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.782 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.23 -156.57 0.13 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.879 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.478 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.27 -37.72 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.87 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.76 122.69 47.17 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.593 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.373 0 O-C-N 124.03 0.831 . . . . 0.0 110.399 176.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 C--O 1.232 0.145 0 CA-C-O 121.219 0.533 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.464 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 71.5 p -119.1 162.3 18.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.159 176.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.526 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.72 -31.42 72.34 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 120.896 0.379 . . . . 0.0 111.334 -178.239 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.464 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.3 -45.21 61.01 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.08 -33.45 73.55 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.749 -177.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.22 -46.32 88.77 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.998 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.554 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.18 -43.36 98.44 Favored 'General case' 0 C--O 1.185 -2.316 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.229 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.545 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.39 -41.41 84.81 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.765 0.666 . . . . 0.0 111.602 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -66.99 -42.79 84.44 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.024 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.691 HG23 HG21 ' B' ' 460' ' ' VAL . 96.6 mt -66.25 -49.14 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.768 177.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -65.57 -35.65 75.75 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.931 -176.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.11 -44.39 91.99 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.491 0.587 . . . . 0.0 110.372 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.3 tp -62.67 -42.01 99.39 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.807 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.527 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 43.0 mt-30 -68.78 -35.67 77.34 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.641 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.485 HD13 HD13 ' A' ' 113' ' ' ILE . 73.3 mt -62.83 -47.0 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.431 178.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.35 -41.81 84.52 Favored 'General case' 0 CA--C 1.513 -0.47 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.701 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.26 -33.15 73.83 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.441 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.1 -44.94 78.72 Favored 'General case' 0 C--O 1.207 -1.159 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 173.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.0 m -65.55 -35.79 81.88 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.72 -42.83 75.89 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 122.089 0.947 . . . . 0.0 108.531 176.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.2 ttmt -61.75 -47.75 83.8 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 113.773 -1.558 . . . . 0.0 111.921 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.17 -28.89 63.51 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.788 -0.765 . . . . 0.0 111.863 177.01 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.95 -47.16 69.41 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.1 -17.52 14.46 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.966 -0.694 . . . . 0.0 112.853 -177.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.45 10.76 Favored Glycine 0 C--N 1.316 -0.53 0 C-N-CA 119.857 -1.163 . . . . 0.0 111.268 -177.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.43 91.37 6.84 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.233 0.539 . . . . 0.0 110.171 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.4 tp . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 178.672 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.435 -1.186 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.1 -52.58 16.12 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.257 -0.902 . . . . 0.0 109.661 -178.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.466 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.5 mp0 -53.23 -51.77 61.1 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.623 -1.626 . . . . 0.0 110.667 -178.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -66.68 -38.68 87.29 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 113.466 -1.697 . . . . 0.0 110.659 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.535 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.9 -44.54 94.19 Favored 'General case' 0 CA--C 1.511 -0.538 0 O-C-N 123.22 0.325 . . . . 0.0 110.402 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.722 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.4 m -68.95 -50.07 52.42 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.703 178.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.455 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.34 -41.37 93.99 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.99 -39.15 90.08 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 100' ' ' ARG . 6.2 tmtt? -60.19 -40.11 88.9 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.98 -41.05 97.64 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.657 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.02 -34.33 78.18 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.824 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.37 74.3 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 177.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.43 -48.86 76.03 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 175.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.552 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.29 -45.53 94.09 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.405 179.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.21 -37.42 85.28 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.564 0.746 . . . . 0.0 111.044 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.84 -43.75 86.07 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.433 HD13 ' HB2' ' A' ' 57' ' ' GLN . 65.6 mt -72.22 -38.58 68.96 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.768 177.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.47 -50.87 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 110.489 -0.189 . . . . 0.0 110.489 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.7 m -60.68 -39.5 88.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.277 0.561 . . . . 0.0 110.557 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.612 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.94 -49.6 60.86 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.005 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.37 -37.12 84.57 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.8 t -65.53 -36.81 78.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.17 0.509 . . . . 0.0 109.644 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.73 80.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.23 0.538 . . . . 0.0 110.25 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.6 mt -71.45 -40.61 70.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.023 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.63 111.2 12.47 Favored Pre-proline 0 C--N 1.317 -0.826 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.936 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.74 -22.66 36.88 Favored 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 122.8 2.334 . . . . 0.0 112.57 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.34 0.13 55.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.101 -177.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.97 134.68 54.44 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.616 -178.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.41 109.11 62.83 Favored Pre-proline 0 CA--C 1.509 -0.614 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.274 177.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.24 157.89 59.85 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 122.303 2.002 . . . . 0.0 111.485 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.55 154.51 24.73 Favored 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 123.603 2.868 . . . . 0.0 111.777 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.06 -32.41 72.74 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 -173.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -73.82 -24.92 59.86 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 123.895 0.747 . . . . 0.0 110.951 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 46.1 t80 . . . . . 0 N--CA 1.454 -0.256 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.295 175.21 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo . . . . . 0 N--CA 1.473 0.284 0 CA-C-O 121.411 0.505 . . . . 0.0 113.358 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 375' ' ' THR . . . . . 0.462 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -117.77 -71.38 0.74 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.119 179.892 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 376' ' ' GLU . . . . . 0.495 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.91 0.01 OUTLIER 'General case' 0 C--O 1.232 0.136 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 377' ' ' VAL . . . . . 0.565 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.66 150.97 7.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.431 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 378' ' ' LEU . . . . . 0.483 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.59 152.51 20.86 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.246 -179.086 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 379' ' ' CYS . . . . . 0.59 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.55 142.61 46.49 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.567 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.513 HD11 HG13 ' B' ' 434' ' ' VAL . 5.4 mt -132.79 103.13 5.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.968 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 10.3 ttt -116.86 162.79 17.17 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.194 -176.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.58 51.25 8.09 Favored 'General case' 0 C--N 1.342 0.262 0 O-C-N 123.208 0.318 . . . . 0.0 111.275 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 383' ' ' MET . . . . . 0.433 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.92 14.39 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.259 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 384' ' ' VAL . . . . . 0.707 HG21 HG23 ' B' ' 432' ' ' ILE . 0.4 OUTLIER -152.3 125.11 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.83 0.347 . . . . 0.0 111.354 179.863 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.69 151.77 43.04 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.428 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.12 -23.53 73.29 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.307 2.005 . . . . 0.0 112.315 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.85 -5.48 53.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.559 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.07 -36.7 5.78 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.901 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 389' ' ' LEU . . . . . 0.474 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.91 0.46 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 390' ' ' LEU . . . . . 0.55 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.53 -15.73 5.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.663 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -98.28 148.77 23.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.574 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -73.52 -30.26 62.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.21 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -75.37 -47.65 26.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.728 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.57 -44.27 91.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.768 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -56.4 -59.34 5.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.249 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.3 61.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.194 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.1 -41.04 67.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.412 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 398' ' ' ILE . . . . . 0.498 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.89 -53.67 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.517 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 399' ' ' VAL . . . . . 0.611 HG22 HD12 ' B' ' 417' ' ' ILE . 59.6 t -53.34 -46.91 58.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.814 -179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.99 3.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.486 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.63 -57.13 11.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.389 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.15 -32.9 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.33 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 403' ' ' ARG . . . . . 0.451 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.2 -57.41 4.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.706 0.288 . . . . 0.0 111.116 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.98 -33.57 64.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.162 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 405' ' ' GLU . . . . . 0.544 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.5 -47.04 44.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.942 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.89 -23.88 67.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.144 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.12 30.38 1.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.961 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.13 -17.17 12.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.863 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.41 14.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.574 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.14 -139.4 4.14 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.586 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.22 132.4 56.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.678 0.275 . . . . 0.0 111.101 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 412' ' ' VAL . . . . . 0.424 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.36 115.43 48.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.01 0.433 . . . . 0.0 110.692 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . 0.68 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.63 -61.95 2.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.186 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.02 -169.4 3.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.088 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 415' ' ' ILE . . . . . 0.611 HG23 HG12 ' B' ' 434' ' ' VAL . 48.7 mt -145.12 128.98 12.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.833 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 416' ' ' GLU . . . . . 0.43 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.87 108.8 18.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.667 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 417' ' ' ILE . . . . . 0.955 HG23 HG21 ' B' ' 432' ' ' ILE . 60.9 mt -128.56 108.6 18.99 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.625 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 418' ' ' PRO . . . . . 0.634 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.6 Cg_endo -48.56 147.65 9.11 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.667 2.245 . . . . 0.0 112.866 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 419' ' ' ARG . . . . . 0.55 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.93 74.73 21.73 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.149 179.854 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -47.15 117.05 2.0 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.728 2.285 . . . . 0.0 112.491 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 421' ' ' VAL . . . . . 0.598 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.2 t -74.36 97.77 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.186 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.65 21.77 9.14 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.479 0.657 . . . . 0.0 109.32 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 423' ' ' GLY . . . . . 0.617 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.26 29.26 6.1 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.328 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 424' ' ' VAL . . . . . 0.598 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.51 -37.45 30.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.94 35.9 4.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 111.776 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 426' ' ' VAL . . . . . 0.678 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.33 -44.74 48.12 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.783 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 427' ' ' PRO . . . . . 0.678 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.29 77.08 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.497 2.131 . . . . 0.0 111.095 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.3 -15.39 3.22 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.359 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.3 t -67.54 149.38 50.22 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.573 0.225 . . . . 0.0 110.82 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.51 -14.2 5.06 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.814 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.43 126.13 44.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.871 0.367 . . . . 0.0 111.092 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 432' ' ' ILE . . . . . 0.955 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -131.05 172.87 15.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.232 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 433' ' ' PHE . . . . . 0.59 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.33 2.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.958 0.409 . . . . 0.0 112.015 -178.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 434' ' ' VAL . . . . . 0.611 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.86 141.68 41.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.18 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 435' ' ' GLU . . . . . 0.492 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.31 108.48 17.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.841 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.7 168.42 12.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.234 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 437' ' ' THR . . . . . 0.68 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -95.02 -45.34 7.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.439 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.94 146.62 52.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 111.198 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.26 -12.7 16.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.248 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.9 24.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.098 0.475 . . . . 0.0 110.078 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -75.07 -29.52 60.71 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.842 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.16 -31.74 72.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.209 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 443' ' ' GLN . . . . . 0.401 ' HB3' HE21 ' B' ' 443' ' ' GLN . 6.2 tt0 -78.72 -47.99 15.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.622 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.1 59.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.709 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.79 -55.76 3.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 446' ' ' MET . . . . . 0.468 ' HB3' HD21 ' B' ' 378' ' ' LEU . 4.2 ptm -63.64 -27.7 69.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.297 -179.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.51 -16.26 63.41 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.632 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.65 -8.58 22.52 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.374 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 449' ' ' LEU . . . . . 0.401 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.71 -19.02 20.02 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.813 0.34 . . . . 0.0 110.969 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 3.6 t -74.37 131.1 40.82 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.989 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.53 -9.65 73.73 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.23 178.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 452' ' ' ARG . . . . . 0.431 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -76.41 -152.23 0.04 OUTLIER 'General case' 0 C--N 1.339 0.133 0 CA-C-N 117.327 0.564 . . . . 0.0 110.495 178.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 453' ' ' LYS . . . . . 0.478 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.79 117.12 2.29 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.811 0.338 . . . . 0.0 111.292 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.2 -36.4 75.29 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.545 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.824 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.29 24.93 0.3 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.771 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 457' ' ' ARG . . . . . 0.426 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.5 135.3 18.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.279 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 46.3 t -63.38 122.44 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.42 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 59.4 t -76.62 121.28 28.49 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.714 -177.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 460' ' ' VAL . . . . . 0.691 HG21 HG23 ' A' ' 53' ' ' ILE . 65.5 t -89.79 96.94 6.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.364 176.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 10.3 t -91.04 153.54 20.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.661 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 462' ' ' LYS . . . . . 0.407 ' HE3' ' HB3' ' B' ' 462' ' ' LYS . 2.0 ttpp -159.18 -167.52 2.09 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 121.106 0.479 . . . . 0.0 110.76 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -114.21 146.99 39.65 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 123.385 0.674 . . . . 0.0 110.452 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 464' ' ' CYS . . . . . 0.565 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.91 149.02 47.36 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.104 0.478 . . . . 0.0 111.286 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 465' ' ' ASP . . . . . 0.462 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.39 129.34 66.67 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.372 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 466' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.04 -33.32 72.84 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.75 2.3 . . . . 0.0 112.097 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.97 -58.52 7.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.441 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.36 -33.78 68.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.336 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 469' ' ' TYR . . . . . 0.492 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.0 -51.27 70.39 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.21 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.36 -47.51 69.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.367 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 471' ' ' ARG . . . . . 0.442 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.13 49.35 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.44 -179.925 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.73 8.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.942 0.401 . . . . 0.0 110.269 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 473' ' ' ASP . . . . . 0.442 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.81 -20.54 23.17 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.006 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 . . . . . 0 N--CA 1.476 0.836 0 C-N-CA 122.92 0.488 . . . . 0.0 112.017 179.027 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.414 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 67.3 m-85 . . . . . 0 C--O 1.231 0.091 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 38.8 Cg_exo -56.38 115.48 2.5 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 123.1 2.533 . . . . 0.0 112.458 -174.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.71 1.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.846 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.38 51.93 12.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.913 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.37 -36.24 3.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.992 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.71 91.86 2.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.86 -54.26 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.83 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.79 111.2 13.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.039 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.05 125.6 25.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.693 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 21' ' ' ARG . 0.9 OUTLIER -112.58 12.75 19.92 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.01 -179.805 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.554 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.9 m95 -141.98 53.11 1.48 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.731 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -156.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.84 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.477 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.37 -37.6 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.91 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.65 113.49 24.41 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.246 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.8 t . . . . . 0 N--CA 1.477 0.886 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -175.317 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.655 0.264 . . . . 0.0 111.593 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 48.5 p -77.56 157.92 30.1 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 173.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.613 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -63.36 -31.32 72.44 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 120.856 0.36 . . . . 0.0 111.319 -173.511 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -72.38 -45.04 61.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.3 -32.83 72.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.735 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.613 ' HG2' ' O ' ' A' ' 46' ' ' ARG . 20.2 pt-20 -66.84 -38.3 86.13 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.028 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.559 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.99 -43.34 96.01 Favored 'General case' 0 C--O 1.185 -2.338 0 CA-C-O 118.877 -0.583 . . . . 0.0 110.25 174.443 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.537 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.43 -41.95 86.21 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 123.794 0.684 . . . . 0.0 111.597 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -64.21 -48.12 77.08 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.834 175.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.699 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 63.5 mt -60.61 -51.8 68.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 120.872 0.368 . . . . 0.0 110.802 177.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.559 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -64.77 -35.62 75.48 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.789 0 CA-C-O 118.67 -0.681 . . . . 0.0 111.919 -174.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.01 -44.31 91.66 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.566 0.621 . . . . 0.0 110.317 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 2.2 pp -71.35 -28.19 63.89 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.884 179.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.619 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 14.2 mm-40 -74.51 -36.25 63.22 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 174.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.48 HD13 HD13 ' A' ' 113' ' ' ILE . 72.9 mt -63.21 -46.97 94.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.404 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.49 -40.86 85.22 Favored 'General case' 0 CA--C 1.513 -0.476 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.7 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -71.67 -30.25 65.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.321 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.542 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.51 -44.93 77.22 Favored 'General case' 0 C--O 1.208 -1.131 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 171.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.62 -35.79 81.82 Favored 'General case' 0 N--CA 1.432 -1.343 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.5 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.84 -42.7 76.16 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 176.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.542 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.81 -47.82 83.38 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 113.856 -1.52 . . . . 0.0 111.848 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.416 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.12 -28.91 63.58 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.883 177.024 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -67.98 -47.14 69.38 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.5 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.1 -17.49 14.47 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.916 0.709 . . . . 0.0 112.916 -177.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.47 10.73 Favored Glycine 0 C--N 1.316 -0.565 0 C-N-CA 119.884 -1.151 . . . . 0.0 111.29 -177.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.39 91.42 6.83 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.229 0.538 . . . . 0.0 110.24 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.626 177.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.436 -1.154 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.1 -52.5 16.47 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.226 -0.922 . . . . 0.0 109.659 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.461 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.4 mp0 -53.32 -51.7 61.55 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 113.677 -1.602 . . . . 0.0 110.659 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -66.73 -38.63 87.05 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.498 -1.683 . . . . 0.0 110.678 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.95 -44.55 94.33 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.177 0.298 . . . . 0.0 110.307 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.704 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.8 m -69.01 -49.99 52.77 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.691 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.454 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.43 -41.28 93.7 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -175.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.0 -39.07 89.98 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.533 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.29 -40.14 89.41 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.91 -41.01 97.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.736 178.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.11 -34.35 78.19 Favored 'General case' 0 C--O 1.21 -1.009 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.712 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.44 -34.34 74.27 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 177.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.54 -48.75 76.24 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 175.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.552 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.35 -45.51 94.08 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.392 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.27 -37.37 85.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.017 -178.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.91 -43.7 86.34 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 177.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.488 HD13 ' HB2' ' A' ' 57' ' ' GLN . 65.4 mt -72.28 -38.53 68.77 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.75 177.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.38 -50.85 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 120.514 0.197 . . . . 0.0 110.544 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 96.2 m -60.81 -39.46 89.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.148 0.499 . . . . 0.0 110.477 -179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.611 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.57 60.93 Favored 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.03 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.32 -37.08 84.56 Favored 'General case' 0 C--O 1.217 -0.621 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.0 t -65.59 -36.88 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.59 -40.76 80.35 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.162 0.505 . . . . 0.0 110.211 177.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 67.0 mt -71.49 -40.61 70.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.995 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.405 ' HA ' ' HD2' ' A' ' 121' ' ' PRO . 45.5 t30 -133.56 111.14 12.54 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.001 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 120' ' ' ASN . 59.7 Cg_endo -68.72 -22.69 36.94 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 122.805 2.337 . . . . 0.0 112.56 -178.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.33 0.14 55.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.336 0.589 . . . . 0.0 111.121 -177.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.96 134.61 54.31 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.651 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.32 109.16 62.89 Favored Pre-proline 0 N--CA 1.446 -0.642 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.332 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.28 157.98 59.49 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.228 1.952 . . . . 0.0 111.473 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.66 154.47 25.47 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 123.598 2.865 . . . . 0.0 111.737 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.06 -30.25 69.4 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -173.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -73.59 -25.27 60.26 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.851 0.719 . . . . 0.0 111.791 -174.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 42.4 t80 . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.723 0.297 . . . . 0.0 110.39 177.952 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo . . . . . 0 CA--C 1.53 0.309 0 N-CA-C 113.586 0.571 . . . . 0.0 113.586 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 375' ' ' THR . . . . . 0.463 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -129.01 -71.32 0.64 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.121 176.883 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 376' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.88 -45.92 0.01 OUTLIER 'General case' 0 C--O 1.232 0.172 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 377' ' ' VAL . . . . . 0.565 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.72 151.02 7.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.423 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 378' ' ' LEU . . . . . 0.472 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.7 152.57 20.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.207 -179.014 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 379' ' ' CYS . . . . . 0.602 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.7 t -115.56 142.61 46.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.641 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.51 HD11 HG13 ' B' ' 434' ' ' VAL . 5.4 mt -132.73 101.49 5.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.979 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 67.2 mtt -116.95 165.7 13.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.911 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.38 51.16 8.53 Favored 'General case' 0 CA--C 1.529 0.152 0 O-C-N 123.609 0.568 . . . . 0.0 111.324 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 383' ' ' MET . . . . . 0.442 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.87 14.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.235 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 384' ' ' VAL . . . . . 0.745 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.36 125.08 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.349 . . . . 0.0 111.369 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.415 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.69 151.72 43.01 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.412 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.1 -23.44 73.42 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.306 2.004 . . . . 0.0 112.342 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.93 -5.47 53.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.504 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.04 -36.8 5.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 389' ' ' LEU . . . . . 0.471 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.96 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.55 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 390' ' ' LEU . . . . . 0.557 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.54 -15.74 5.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.676 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -98.33 148.76 23.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.555 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -73.56 -30.26 62.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.218 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.39 -47.58 26.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.794 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.54 -44.27 91.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.795 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.43 -59.33 5.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -27.33 61.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.08 -41.09 67.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.418 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 398' ' ' ILE . . . . . 0.497 HD13 HG12 ' B' ' 384' ' ' VAL . 65.6 mt -74.86 -53.74 15.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.491 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 399' ' ' VAL . . . . . 0.622 HG22 HD12 ' B' ' 417' ' ' ILE . 59.8 t -53.28 -46.91 57.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.85 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.43 -59.99 3.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.5 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.65 -57.19 11.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.39 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.12 -32.85 15.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.333 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 403' ' ' ARG . . . . . 0.459 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.2 -57.43 4.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 111.141 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.94 -33.61 64.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.205 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 405' ' ' GLU . . . . . 0.554 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.44 -47.08 44.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.001 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.78 -24.04 67.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.137 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.33 1.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.97 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.04 -17.17 12.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -106.68 -15.38 14.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.594 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.15 -139.46 4.17 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.616 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 411' ' ' LEU . . . . . 0.417 ' HA ' HD13 ' B' ' 411' ' ' LEU . 1.6 mm? -114.21 132.5 56.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.645 0.259 . . . . 0.0 111.11 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 412' ' ' VAL . . . . . 0.423 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.41 115.37 48.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.007 0.432 . . . . 0.0 110.631 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . 0.703 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.59 -62.0 2.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.225 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.95 -169.35 3.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.109 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 415' ' ' ILE . . . . . 0.616 HG23 HG12 ' B' ' 434' ' ' VAL . 48.7 mt -145.13 128.99 12.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.842 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 416' ' ' GLU . . . . . 0.423 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.8 108.76 18.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.712 179.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 417' ' ' ILE . . . . . 1.018 HG23 HG21 ' B' ' 432' ' ' ILE . 60.7 mt -128.56 108.53 18.98 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.725 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 418' ' ' PRO . . . . . 0.631 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.45 147.61 8.85 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.664 2.243 . . . . 0.0 112.965 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 419' ' ' ARG . . . . . 0.557 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.9 74.72 21.88 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.145 179.891 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.2 117.15 2.08 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.749 2.3 . . . . 0.0 112.434 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 421' ' ' VAL . . . . . 0.599 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 95.9 t -74.44 97.82 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.171 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.59 21.77 9.05 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.596 0.713 . . . . 0.0 109.353 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 423' ' ' GLY . . . . . 0.649 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.27 29.28 6.09 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.232 -179.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 424' ' ' VAL . . . . . 0.599 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.48 -37.49 30.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.94 35.81 4.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.787 0.327 . . . . 0.0 111.774 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 426' ' ' VAL . . . . . 0.671 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.26 -44.75 48.97 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.827 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 427' ' ' PRO . . . . . 0.671 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.2 Cg_endo -66.32 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.443 2.095 . . . . 0.0 111.078 179.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.29 -15.4 3.22 Favored Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.306 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.59 149.34 50.22 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.582 0.23 . . . . 0.0 110.829 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.49 -14.16 5.07 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.879 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.42 126.2 44.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 110.979 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 432' ' ' ILE . . . . . 1.018 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.06 172.94 15.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.279 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 433' ' ' PHE . . . . . 0.602 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.51 -176.42 2.81 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.968 0.413 . . . . 0.0 111.994 -178.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 434' ' ' VAL . . . . . 0.616 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.76 141.76 41.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.165 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 435' ' ' GLU . . . . . 0.483 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.7 tt0 -84.35 108.48 17.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.811 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.74 168.37 12.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.239 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 437' ' ' THR . . . . . 0.703 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.5 p -94.96 -45.32 7.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.465 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.93 146.59 52.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.077 0.465 . . . . 0.0 111.165 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.17 -12.8 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.239 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -54.91 24.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.152 0.501 . . . . 0.0 110.083 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -75.1 -29.46 60.61 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.805 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -31.86 72.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.142 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.59 -47.94 16.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.703 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.7 -11.97 59.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.723 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -56.16 3.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.898 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 446' ' ' MET . . . . . 0.42 ' HB3' HD21 ' B' ' 378' ' ' LEU . 2.9 ptm -61.54 -29.71 70.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.285 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.23 -16.23 63.55 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.626 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.59 -8.63 22.57 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.443 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 449' ' ' LEU . . . . . 0.403 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.68 -19.78 19.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.806 0.336 . . . . 0.0 110.943 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 21.8 p -70.71 130.06 40.76 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.992 175.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.49 -8.9 74.59 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.578 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 452' ' ' ARG . . . . . 0.425 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.98 -152.2 0.05 Allowed 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 117.206 0.503 . . . . 0.0 110.531 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 453' ' ' LYS . . . . . 0.477 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.11 2.29 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.858 0.361 . . . . 0.0 111.326 -179.902 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.3 -36.34 75.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.551 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.25 -50.96 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.82 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -157.2 24.94 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.753 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 457' ' ' ARG . . . . . 0.442 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.47 133.04 16.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.309 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 458' ' ' VAL . . . . . 0.404 HG12 HE22 ' A' ' 57' ' ' GLN . 7.1 p -64.42 135.92 27.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 O-C-N 121.656 -0.652 . . . . 0.0 111.183 -177.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 459' ' ' VAL . . . . . 0.459 HG12 HG23 ' B' ' 461' ' ' THR . 45.1 t -91.1 121.55 41.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.167 -176.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 460' ' ' VAL . . . . . 0.466 HG21 ' CD1' ' A' ' 53' ' ' ILE . 4.7 m -94.35 98.09 7.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.507 0.67 . . . . 0.0 110.488 176.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 461' ' ' THR . . . . . 0.459 HG23 HG12 ' B' ' 459' ' ' VAL . 17.0 p -97.53 128.88 44.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.122 -177.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 462' ' ' LYS . . . . . 0.557 ' HG3' ' HB3' ' B' ' 379' ' ' CYS . 5.8 ptmt -130.14 -160.5 1.04 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.742 -178.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 463' ' ' TYR . . . . . 0.426 ' H ' ' HB2' ' B' ' 462' ' ' LYS . 1.2 m-85 -114.96 147.01 40.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.59 -175.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 464' ' ' CYS . . . . . 0.565 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.92 148.98 47.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.15 0.5 . . . . 0.0 111.33 -179.901 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 465' ' ' ASP . . . . . 0.463 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.39 129.42 66.33 Favored Pre-proline 0 CA--C 1.529 0.153 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.373 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 466' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.11 -33.23 73.19 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.704 2.269 . . . . 0.0 112.06 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.53 7.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.374 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.43 -33.77 68.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 469' ' ' TYR . . . . . 0.483 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.05 -51.21 70.61 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.221 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.31 -47.59 69.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.393 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 471' ' ' ARG . . . . . 0.45 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.65 -2.11 49.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.432 -179.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.01 20.86 8.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.924 0.393 . . . . 0.0 110.232 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 473' ' ' ASP . . . . . 0.45 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.88 -20.82 25.14 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.947 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 . . . . . 0 N--CA 1.471 0.601 0 CA-C-O 120.952 0.406 . . . . 0.0 111.078 -177.57 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.368 0.128 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.18 115.53 2.54 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.932 2.422 . . . . 0.0 112.32 177.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.02 -166.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.85 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.44 51.92 12.11 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.896 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.4 -36.21 3.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.927 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.72 91.85 2.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.96 -54.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.837 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.14 13.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.945 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.9 125.57 24.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.806 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 21' ' ' ARG . 0.9 OUTLIER -112.62 12.83 19.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.982 -179.763 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.549 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 72.0 m95 -142.02 53.1 1.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.756 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.28 -156.64 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.794 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.484 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.25 -37.73 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.852 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.71 120.58 40.56 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.534 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.6 p . . . . . 0 C--N 1.331 -0.239 0 O-C-N 124.007 0.817 . . . . 0.0 110.869 -178.718 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.482 ' HB3' ' HG3' ' A' ' 49' ' ' GLU . 3.6 mm? . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.93 0.395 . . . . 0.0 111.479 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.423 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 7.6 p -90.76 155.93 18.44 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.35 173.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.525 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -63.01 -31.29 72.4 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 120.933 0.397 . . . . 0.0 111.388 -174.253 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.423 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.35 -45.06 61.53 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.29 -33.49 73.27 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.763 -177.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.482 ' HG3' ' HB3' ' A' ' 44' ' ' LEU . 43.6 mt-10 -61.04 -44.54 97.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.21 177.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.558 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.77 -43.38 98.94 Favored 'General case' 0 C--O 1.185 -2.318 0 CA-C-O 118.884 -0.579 . . . . 0.0 110.234 177.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.551 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.41 -43.41 88.62 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 123.739 0.65 . . . . 0.0 111.535 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -65.4 -39.07 91.74 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.858 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.684 ' HA ' HD23 ' A' ' 56' ' ' LEU . 36.0 mm -78.64 -41.09 24.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.365 -178.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.1 m -65.57 -35.5 75.39 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.84 0 CA-C-O 118.664 -0.684 . . . . 0.0 111.898 176.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.05 -43.04 91.65 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.509 0.595 . . . . 0.0 110.353 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.684 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.3 OUTLIER -64.93 -38.62 91.56 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.646 177.55 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.51 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 61.8 mt-30 -75.14 -30.37 60.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.421 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.47 HD13 HD13 ' A' ' 113' ' ' ILE . 72.5 mt -65.8 -47.02 87.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 122.836 0.454 . . . . 0.0 110.341 175.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.42 -41.16 85.3 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.64 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -70.33 -31.37 68.64 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.225 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.537 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.64 -44.92 76.76 Favored 'General case' 0 C--O 1.207 -1.162 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 172.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.5 -35.81 82.0 Favored 'General case' 0 N--CA 1.432 -1.346 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -178.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.501 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.79 -42.76 76.05 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.537 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.79 -47.76 83.68 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 113.846 -1.524 . . . . 0.0 111.93 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.416 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.04 -29.0 63.73 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.867 176.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.96 -47.13 69.47 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.501 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.07 -17.69 14.41 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 119.974 -0.69 . . . . 0.0 112.815 -177.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.89 29.41 10.6 Favored Glycine 0 C--N 1.315 -0.621 0 C-N-CA 119.896 -1.145 . . . . 0.0 111.254 -177.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.4 92.95 7.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.214 0.531 . . . . 0.0 110.135 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.8 tp . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.536 177.216 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.436 -1.144 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.09 -52.53 16.36 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.218 -0.926 . . . . 0.0 109.667 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.462 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.6 mp0 -53.34 -51.74 61.46 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-N 113.614 -1.63 . . . . 0.0 110.66 -178.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -66.61 -38.75 87.63 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 113.456 -1.702 . . . . 0.0 110.653 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.533 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.87 -44.51 94.12 Favored 'General case' 0 CA--C 1.512 -0.495 0 O-C-N 123.265 0.353 . . . . 0.0 110.356 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.728 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.8 m -69.02 -50.05 52.26 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 120.069 -0.653 . . . . 0.0 110.637 179.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.45 -41.24 93.66 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -175.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.08 -39.1 89.78 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.19 -40.16 89.07 Favored 'General case' 0 C--O 1.223 -0.308 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.728 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.93 -41.09 97.73 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.648 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.0 -34.45 78.47 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.73 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.44 -34.29 74.21 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.55 -48.79 76.05 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.607 -1.256 . . . . 0.0 107.607 175.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.559 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.24 -45.54 94.11 Favored 'General case' 0 C--O 1.213 -0.819 0 CA-C-N 114.494 -1.23 . . . . 0.0 110.436 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.28 -37.42 85.46 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.565 0.746 . . . . 0.0 110.99 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.78 -43.74 85.78 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.7 mt -72.23 -38.63 68.92 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.769 177.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.559 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.39 -50.91 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 110.51 -0.181 . . . . 0.0 110.51 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.5 m -60.7 -39.46 88.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.195 0.521 . . . . 0.0 110.535 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.611 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.52 61.24 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.004 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.43 -37.09 84.41 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.8 t -65.54 -36.86 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 176.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.72 80.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.226 0.536 . . . . 0.0 110.23 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.7 mt -71.61 -40.5 69.77 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.984 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.58 111.19 12.53 Favored Pre-proline 0 C--N 1.315 -0.896 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.013 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.68 -22.81 36.99 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.837 2.358 . . . . 0.0 112.558 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.16 0.01 55.98 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.191 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.94 134.7 54.53 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.617 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.39 109.07 62.8 Favored Pre-proline 0 CA--C 1.51 -0.589 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.32 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.23 157.93 59.67 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 122.261 1.974 . . . . 0.0 111.501 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.64 154.5 25.23 Favored 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 123.626 2.884 . . . . 0.0 111.768 177.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.08 -31.37 70.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -91.77 34.96 0.97 Allowed 'General case' 0 C--O 1.233 0.22 0 O-C-N 123.474 0.484 . . . . 0.0 111.618 -177.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 41.4 t80 . . . . . 0 C--N 1.331 -0.227 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.215 176.574 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo . . . . . 0 N--CA 1.473 0.299 0 CA-C-O 120.753 0.231 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 375' ' ' THR . . . . . 0.468 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -143.35 -71.42 0.31 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.179 -177.557 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 376' ' ' GLU . . . . . 0.485 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.9 -45.91 0.01 OUTLIER 'General case' 0 C--O 1.231 0.108 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 377' ' ' VAL . . . . . 0.558 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.95 7.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.478 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 378' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.63 152.5 20.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.193 -178.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 379' ' ' CYS . . . . . 0.604 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.53 142.53 46.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.631 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.61 HD23 HG22 ' B' ' 461' ' ' THR . 5.3 mt -132.71 102.33 5.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.377 . . . . 0.0 111.01 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 21.6 ttt -117.15 164.89 14.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.26 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.2 t30 58.15 51.12 8.97 Favored 'General case' 0 C--O 1.232 0.154 0 O-C-N 123.338 0.399 . . . . 0.0 111.278 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 383' ' ' MET . . . . . 0.79 ' HB3' HG12 ' B' ' 459' ' ' VAL . 3.0 ptm -164.86 14.37 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.258 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 384' ' ' VAL . . . . . 0.733 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.27 125.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 0.0 111.372 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.83 151.7 43.08 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.4 179.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.07 -23.52 73.62 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.353 2.035 . . . . 0.0 112.36 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.89 -5.48 53.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.494 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.77 5.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.872 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 389' ' ' LEU . . . . . 0.473 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.97 0.46 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.969 0.414 . . . . 0.0 110.615 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.58 -15.72 5.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.652 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.36 148.76 23.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.542 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -73.57 -30.16 62.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.276 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.42 -47.66 26.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.713 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.6 -44.25 91.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.743 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.44 -59.32 5.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.221 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -27.38 61.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.27 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.08 -41.06 67.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.423 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 398' ' ' ILE . . . . . 0.493 HD13 HG12 ' B' ' 384' ' ' VAL . 65.5 mt -74.94 -53.64 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.516 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 399' ' ' VAL . . . . . 0.615 HG22 HD12 ' B' ' 417' ' ' ILE . 59.4 t -53.25 -46.98 57.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.807 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.42 -60.0 3.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.789 0.328 . . . . 0.0 111.523 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.52 -57.31 11.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.359 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.01 -32.96 15.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.326 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 403' ' ' ARG . . . . . 0.46 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.2 OUTLIER -71.18 -57.38 4.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.715 0.293 . . . . 0.0 111.149 -179.919 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.93 -33.69 64.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.15 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 405' ' ' GLU . . . . . 0.549 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.43 -47.02 45.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.96 -23.87 67.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.171 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.39 1.1 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.966 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.1 -17.17 12.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.877 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.61 -15.47 14.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.561 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.12 -139.41 4.15 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.536 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.29 132.46 56.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.714 0.292 . . . . 0.0 111.065 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 412' ' ' VAL . . . . . 0.433 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.39 115.46 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.991 0.424 . . . . 0.0 110.58 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.64 -61.93 2.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.226 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.04 -169.4 3.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.109 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 415' ' ' ILE . . . . . 0.617 HG23 HG12 ' B' ' 434' ' ' VAL . 48.8 mt -145.09 128.83 11.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 416' ' ' GLU . . . . . 0.436 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.78 108.83 18.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.732 179.781 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 417' ' ' ILE . . . . . 1.008 HG23 HG21 ' B' ' 432' ' ' ILE . 60.5 mt -128.53 108.47 19.04 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.708 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 418' ' ' PRO . . . . . 0.632 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.5 147.6 9.01 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.663 2.242 . . . . 0.0 112.904 -179.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.84 74.75 22.06 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.143 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.27 117.11 2.07 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.79 2.327 . . . . 0.0 112.402 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 421' ' ' VAL . . . . . 0.581 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.5 t -74.39 97.78 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.187 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.57 21.82 9.06 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.557 0.694 . . . . 0.0 109.314 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 423' ' ' GLY . . . . . 0.648 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.39 29.22 6.07 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.278 -179.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 424' ' ' VAL . . . . . 0.581 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.5 -37.6 30.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.103 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.84 35.97 4.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.804 0.335 . . . . 0.0 111.753 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 426' ' ' VAL . . . . . 0.667 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.39 -44.63 47.0 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.819 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 427' ' ' PRO . . . . . 0.667 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.33 77.07 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.473 2.115 . . . . 0.0 111.107 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.31 -15.38 3.21 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.313 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.2 t -67.52 149.39 50.23 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.511 0.196 . . . . 0.0 110.885 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.5 -14.27 5.06 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.912 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.37 126.17 44.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.845 0.355 . . . . 0.0 111.08 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 432' ' ' ILE . . . . . 1.008 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.08 172.93 15.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.281 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 433' ' ' PHE . . . . . 0.604 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.37 2.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.958 0.409 . . . . 0.0 111.962 -178.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 434' ' ' VAL . . . . . 0.617 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.82 141.72 41.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.176 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 435' ' ' GLU . . . . . 0.486 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.4 108.55 17.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.821 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.78 168.37 12.52 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.249 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 437' ' ' THR . . . . . 0.698 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -94.96 -45.43 7.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.404 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.85 146.69 52.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.128 0.489 . . . . 0.0 111.183 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.22 -12.84 16.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.192 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.8 26.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.123 0.487 . . . . 0.0 110.129 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.15 -29.44 60.48 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.889 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.14 -31.81 72.34 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.186 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.69 -48.03 15.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.646 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.07 59.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.709 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.83 -54.9 3.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.961 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 446' ' ' MET . . . . . 0.474 ' HB3' HD21 ' B' ' 378' ' ' LEU . 4.1 ptm -64.76 -27.57 68.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.957 -179.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.58 -16.2 63.36 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.64 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.66 -8.53 22.57 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.464 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 449' ' ' LEU . . . . . 0.408 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.3 mt -95.82 -19.77 19.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.712 0.291 . . . . 0.0 110.916 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 450' ' ' THR . . . . . 0.434 HG23 ' O ' ' B' ' 446' ' ' MET . 23.1 p -69.54 131.36 44.57 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.104 175.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.63 -9.59 76.66 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.677 -0.773 . . . . 0.0 113.377 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 452' ' ' ARG . . . . . 0.427 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -75.74 -152.2 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 117.2 0.5 . . . . 0.0 110.513 178.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 453' ' ' LYS . . . . . 0.484 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.87 117.15 2.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.948 0.404 . . . . 0.0 111.338 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.23 -36.4 75.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.542 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.21 -50.98 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.846 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.25 25.0 0.3 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.787 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 457' ' ' ARG . . . . . 0.434 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.47 136.22 19.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.325 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 458' ' ' VAL . . . . . 0.458 HG12 HE21 ' A' ' 57' ' ' GLN . 7.2 p -58.38 132.23 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 121.124 0.488 . . . . 0.0 110.949 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 459' ' ' VAL . . . . . 0.79 HG12 ' HB3' ' B' ' 383' ' ' MET . 0.9 OUTLIER -90.99 122.12 42.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.819 -174.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 460' ' ' VAL . . . . . 0.445 HG21 HG13 ' A' ' 53' ' ' ILE . 59.6 t -88.89 98.21 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.319 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 461' ' ' THR . . . . . 0.61 HG22 HD23 ' B' ' 380' ' ' LEU . 1.4 p -98.12 129.64 44.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.842 177.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 462' ' ' LYS . . . . . 0.467 ' HE3' ' HB2' ' B' ' 462' ' ' LYS . 0.5 OUTLIER -130.58 -166.35 1.67 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.268 0.556 . . . . 0.0 111.148 -179.045 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.59 146.93 37.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.525 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 464' ' ' CYS . . . . . 0.558 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.81 148.98 47.48 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.065 0.46 . . . . 0.0 111.378 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 465' ' ' ASP . . . . . 0.468 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.46 129.35 66.42 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.398 -179.881 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 466' ' ' PRO . . . . . 0.485 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.06 -33.21 72.62 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.685 2.257 . . . . 0.0 112.103 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.07 -58.48 7.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.38 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.5 -33.67 68.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.25 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 469' ' ' TYR . . . . . 0.486 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.1 -51.18 70.7 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.183 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.37 -47.53 69.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.37 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 471' ' ' ARG . . . . . 0.451 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.73 -2.09 49.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.45 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.09 20.8 8.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.975 0.417 . . . . 0.0 110.275 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 473' ' ' ASP . . . . . 0.451 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.85 -21.48 29.49 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.954 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 . . . . . 0 N--CA 1.472 0.646 0 C-N-CA 123.121 0.568 . . . . 0.0 111.264 -177.388 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 31.3 p90 . . . . . 0 C--O 1.233 0.189 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 38.8 Cg_exo -56.52 115.56 2.57 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 123.265 2.643 . . . . 0.0 112.323 -174.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.92 12.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.94 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.36 -36.27 3.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.995 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.8 2.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.856 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.84 -54.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.812 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.9 111.13 13.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.94 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.92 125.59 24.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.697 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.62 12.88 19.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.992 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.553 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.8 m95 -142.06 53.02 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.706 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.29 -156.54 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.84 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.471 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.33 -37.63 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.867 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.75 121.29 42.86 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.557 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 p . . . . . 0 C--N 1.327 -0.388 0 O-C-N 123.625 0.578 . . . . 0.0 111.067 179.207 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 44' ' ' LEU . 3.4 mm? . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.927 0.394 . . . . 0.0 111.521 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.459 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 1.4 p -84.93 154.27 22.31 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.605 175.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.522 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.06 -31.3 71.71 Favored 'General case' 0 C--O 1.24 0.597 0 O-C-N 123.368 0.418 . . . . 0.0 111.395 -175.029 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.459 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.3 -45.23 60.91 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.18 -32.69 72.17 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.753 -177.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.454 ' O ' HG12 ' A' ' 53' ' ' ILE . 36.1 mt-10 -61.16 -44.78 96.78 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.243 178.01 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.561 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.37 -43.32 97.94 Favored 'General case' 0 C--O 1.186 -2.252 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.235 177.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.552 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.43 -42.13 86.61 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 123.719 0.637 . . . . 0.0 111.585 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -66.29 -38.86 88.76 Favored 'General case' 0 N--CA 1.462 0.165 0 O-C-N 123.824 0.703 . . . . 0.0 110.933 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.598 ' HA ' HD23 ' A' ' 56' ' ' LEU . 29.6 mm -78.31 -41.52 26.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.197 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.561 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -66.41 -35.44 74.92 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.809 0 CA-C-O 118.586 -0.721 . . . . 0.0 111.958 177.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.15 -45.43 90.99 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 118.541 0.61 . . . . 0.0 110.308 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.598 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.1 OUTLIER -70.55 -23.71 62.67 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.077 -178.321 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -89.53 -26.67 20.75 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.669 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.487 HD13 HD13 ' A' ' 113' ' ' ILE . 72.7 mt -64.04 -46.94 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.175 0.59 . . . . 0.0 110.395 170.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.433 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.45 -41.15 85.17 Favored 'General case' 0 CA--C 1.513 -0.474 0 C-N-CA 120.294 -0.563 . . . . 0.0 110.685 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -36.5 83.11 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.844 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.529 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -66.61 -44.95 80.71 Favored 'General case' 0 C--O 1.206 -1.187 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.51 -35.81 81.98 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.82 -42.76 76.19 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 122.095 0.95 . . . . 0.0 108.53 176.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.529 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.76 -47.73 83.88 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 113.827 -1.533 . . . . 0.0 111.897 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.423 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.23 -28.79 63.39 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 119.741 -0.784 . . . . 0.0 111.831 176.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -68.1 -47.07 69.19 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.48 14.46 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 119.965 -0.694 . . . . 0.0 112.86 -177.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.77 29.41 10.74 Favored Glycine 0 C--N 1.316 -0.565 0 C-N-CA 119.804 -1.188 . . . . 0.0 111.28 -177.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.4 91.08 6.77 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.253 0.549 . . . . 0.0 110.215 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.454 178.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.435 -1.206 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.11 -52.5 16.46 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.261 -0.9 . . . . 0.0 109.706 -178.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.458 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.3 mp0 -53.34 -51.7 61.58 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-N 113.663 -1.608 . . . . 0.0 110.656 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.64 -38.75 87.55 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.435 -1.712 . . . . 0.0 110.704 -177.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.53 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.83 -44.59 93.98 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 123.237 0.336 . . . . 0.0 110.371 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.722 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.7 m -69.05 -50.0 52.49 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.613 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.46 -41.27 93.55 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -175.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.0 -39.17 90.05 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 110.351 -0.241 . . . . 0.0 110.351 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 100' ' ' ARG . 6.2 tmtt? -60.23 -40.13 89.12 Favored 'General case' 0 C--O 1.223 -0.308 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.93 -41.06 97.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.135 -0.938 . . . . 0.0 110.663 178.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.01 -34.36 78.26 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.811 178.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.52 -34.29 74.05 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 177.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.45 -48.86 75.99 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 175.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.559 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.2 ttp180 -61.26 -45.51 94.21 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.441 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.21 -37.47 85.47 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 123.567 0.747 . . . . 0.0 111.016 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.79 -43.73 85.8 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.8 mt -72.3 -38.49 68.73 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.814 177.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.559 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.4 -50.98 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 110.472 -0.195 . . . . 0.0 110.472 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.9 m -60.6 -39.6 88.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.219 0.533 . . . . 0.0 110.514 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.608 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.89 -49.64 60.83 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.952 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.1 84.46 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.3 t -65.52 -36.87 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 176.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.7 79.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.197 0.523 . . . . 0.0 110.22 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.3 mt -71.46 -40.56 70.23 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.045 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.63 111.22 12.48 Favored Pre-proline 0 C--N 1.316 -0.853 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.76 -22.63 36.8 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.861 2.374 . . . . 0.0 112.588 -178.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.34 0.07 55.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.405 0.621 . . . . 0.0 111.178 -177.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.84 134.61 54.43 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.61 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.35 109.16 62.89 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.323 177.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.27 157.92 59.76 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.271 1.981 . . . . 0.0 111.501 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.56 154.5 24.82 Favored 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 123.648 2.899 . . . . 0.0 111.813 177.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.1 -31.49 71.13 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -90.08 20.73 4.1 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 123.771 0.669 . . . . 0.0 111.733 -176.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 23.2 t80 . . . . . 0 C--N 1.331 -0.224 0 CA-C-O 120.815 0.34 . . . . 0.0 110.151 175.583 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 CA--C 1.529 0.262 0 CA-C-O 121.114 0.381 . . . . 0.0 112.973 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 375' ' ' THR . . . . . 0.454 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -120.84 -71.3 0.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.166 178.638 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 376' ' ' GLU . . . . . 0.492 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.96 0.01 OUTLIER 'General case' 0 C--O 1.231 0.097 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 377' ' ' VAL . . . . . 0.554 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.95 7.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.471 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 378' ' ' LEU . . . . . 0.49 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.55 152.54 20.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.271 -179.072 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 379' ' ' CYS . . . . . 0.611 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.57 142.53 46.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.59 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.51 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.73 101.82 5.43 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.925 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 381' ' ' MET . . . . . 0.403 ' HG2' ' N ' ' B' ' 382' ' ' ASN . 20.3 ttt -116.83 164.7 14.27 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.59 -178.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 382' ' ' ASN . . . . . 0.403 ' N ' ' HG2' ' B' ' 381' ' ' MET . 13.1 t30 58.58 51.19 8.14 Favored 'General case' 0 C--N 1.342 0.278 0 O-C-N 123.479 0.487 . . . . 0.0 111.316 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 383' ' ' MET . . . . . 0.433 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.85 14.4 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.253 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 384' ' ' VAL . . . . . 0.737 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.31 125.17 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.845 0.355 . . . . 0.0 111.311 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.412 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.0 mt -110.78 151.78 43.1 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.34 179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.25 -23.35 72.5 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.273 1.982 . . . . 0.0 112.343 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.94 -5.52 53.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.484 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.02 -36.76 5.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.904 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 389' ' ' LEU . . . . . 0.477 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.96 34.92 0.46 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.913 0.387 . . . . 0.0 110.636 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.55 -15.66 5.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.659 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.31 148.71 23.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.573 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -73.5 -30.25 63.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.225 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.35 -47.68 26.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.754 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.51 -44.26 91.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.852 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.41 -59.45 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.162 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -27.29 61.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.275 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.23 -40.94 67.39 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.429 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 398' ' ' ILE . . . . . 0.496 HD13 HG12 ' B' ' 384' ' ' VAL . 65.5 mt -74.93 -53.65 16.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.525 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 399' ' ' VAL . . . . . 0.617 HG22 HD12 ' B' ' 417' ' ' ILE . 59.7 t -53.3 -46.86 57.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.846 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.47 -60.0 3.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.74 0.305 . . . . 0.0 111.526 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.69 -57.14 11.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.341 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.7 t -52.04 -32.99 15.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.387 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 403' ' ' ARG . . . . . 0.46 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.15 -57.39 4.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 111.173 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.9 -33.62 64.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.214 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 405' ' ' GLU . . . . . 0.553 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 22.0 mm-40 -73.48 -47.06 44.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.963 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.81 -23.97 67.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.131 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.08 30.25 1.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.895 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.01 -17.18 12.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.42 14.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.551 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.14 -139.46 4.17 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.553 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.21 132.51 56.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.09 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 412' ' ' VAL . . . . . 0.422 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.38 115.45 48.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.028 0.442 . . . . 0.0 110.658 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.69 -61.97 2.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.179 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.96 -169.33 3.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.188 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 415' ' ' ILE . . . . . 0.613 HG23 HG12 ' B' ' 434' ' ' VAL . 48.6 mt -145.2 128.94 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.825 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 416' ' ' GLU . . . . . 0.429 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.93 108.76 18.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.692 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 417' ' ' ILE . . . . . 0.969 HG23 HG21 ' B' ' 432' ' ' ILE . 60.1 mt -128.42 108.48 19.24 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.688 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 418' ' ' PRO . . . . . 0.637 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.48 147.61 8.95 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.673 2.248 . . . . 0.0 112.913 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.86 74.61 22.1 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.155 179.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.1 117.0 1.96 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.782 2.321 . . . . 0.0 112.46 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 421' ' ' VAL . . . . . 0.599 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.2 t -74.34 97.84 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.199 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.5 21.84 8.99 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.61 0.719 . . . . 0.0 109.386 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 423' ' ' GLY . . . . . 0.634 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.31 29.21 6.1 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.273 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 424' ' ' VAL . . . . . 0.599 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.42 -37.57 31.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.86 35.92 4.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.331 . . . . 0.0 111.825 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 426' ' ' VAL . . . . . 0.677 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.41 -44.59 46.65 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.827 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 427' ' ' PRO . . . . . 0.677 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.8 Cg_endo -66.3 77.07 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.516 2.144 . . . . 0.0 111.113 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.34 -15.47 3.2 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.338 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.53 149.37 50.25 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.591 0.234 . . . . 0.0 110.793 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.54 -14.24 5.05 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.856 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 126.16 44.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.833 0.349 . . . . 0.0 111.028 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 432' ' ' ILE . . . . . 0.969 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -131.03 172.89 15.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.243 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 433' ' ' PHE . . . . . 0.611 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.3 2.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.989 0.423 . . . . 0.0 111.974 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 434' ' ' VAL . . . . . 0.613 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.88 141.71 41.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.207 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 435' ' ' GLU . . . . . 0.484 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.3 108.49 17.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.819 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.79 168.36 12.53 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.227 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 437' ' ' THR . . . . . 0.698 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.93 -45.39 7.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.438 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.91 146.66 52.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.096 0.474 . . . . 0.0 111.215 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.25 -12.7 16.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.263 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.87 25.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.082 0.468 . . . . 0.0 110.088 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.16 -29.37 60.43 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.864 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.32 -31.68 72.32 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.168 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 443' ' ' GLN . . . . . 0.4 HE21 ' HB3' ' B' ' 443' ' ' GLN . 6.2 tt0 -78.64 -48.06 15.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.649 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.08 59.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.719 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -55.6 3.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.993 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 446' ' ' MET . . . . . 0.49 ' HB3' HD21 ' B' ' 378' ' ' LEU . 3.4 ptm -64.14 -26.98 68.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.178 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.16 -16.25 63.06 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.625 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.51 22.7 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.415 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 449' ' ' LEU . . . . . 0.66 ' HB2' HG21 ' B' ' 461' ' ' THR . 97.2 mt -95.72 -20.55 18.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.797 0.332 . . . . 0.0 110.894 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 3.3 t -72.59 131.72 42.83 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.899 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.98 -9.81 72.53 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.157 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 452' ' ' ARG . . . . . 0.417 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.3 mmm180 -77.11 -152.22 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 117.239 0.52 . . . . 0.0 110.587 178.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 453' ' ' LYS . . . . . 0.471 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.83 117.08 2.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.853 0.358 . . . . 0.0 111.285 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.23 -36.43 75.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.524 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.16 -50.92 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.814 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.23 24.86 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.761 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 457' ' ' ARG . . . . . 0.433 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.38 134.77 18.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.344 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 2.8 m -59.65 138.42 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-O 121.042 0.449 . . . . 0.0 111.62 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 57.5 t -98.73 115.79 40.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.419 -176.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 460' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -82.81 114.5 23.75 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.796 174.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 461' ' ' THR . . . . . 0.66 HG21 ' HB2' ' B' ' 449' ' ' LEU . 14.1 p -100.96 132.14 46.51 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.139 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 462' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.46 -175.74 3.54 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.727 0.775 . . . . 0.0 111.455 -177.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -111.54 146.9 36.5 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.473 172.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 464' ' ' CYS . . . . . 0.554 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 149.03 47.47 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.992 0.425 . . . . 0.0 111.431 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 465' ' ' ASP . . . . . 0.454 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.46 129.36 66.37 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.374 -179.812 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 466' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -53.98 -33.31 72.16 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.76 2.307 . . . . 0.0 112.127 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -58.49 7.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.399 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.44 -33.72 68.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.278 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 469' ' ' TYR . . . . . 0.484 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.03 -51.23 70.54 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.203 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.36 -47.6 69.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.291 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 471' ' ' ARG . . . . . 0.453 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.67 -2.19 49.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.383 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.78 8.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 0.0 110.234 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 473' ' ' ASP . . . . . 0.453 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.66 -20.45 21.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.951 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 11.5 p90 . . . . . 0 N--CA 1.477 0.884 0 C-N-CA 124.82 1.248 . . . . 0.0 112.771 -177.428 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 . . . . . 0 C--O 1.233 0.192 0 CA-C-O 120.455 0.169 . . . . 0.0 110.948 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.28 115.57 2.57 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.936 2.424 . . . . 0.0 112.25 172.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.02 -166.75 1.32 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.859 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.91 12.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.878 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.3 -36.29 3.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.043 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.76 91.89 2.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.855 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.9 -54.33 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.786 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.82 111.24 13.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.01 125.63 25.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.787 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.59 12.78 19.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.976 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.552 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.4 m95 -141.97 53.08 1.48 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.791 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -156.58 0.13 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.854 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.475 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.33 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.927 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.73 120.36 39.81 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.609 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.9 m . . . . . 0 C--N 1.331 -0.211 0 O-C-N 123.655 0.597 . . . . 0.0 110.782 -177.578 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.497 ' CD2' ' HB2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.22 0 CA-C-O 120.942 0.401 . . . . 0.0 111.665 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.52 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 23.3 p -106.08 163.43 12.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.178 178.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.512 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -60.98 -31.39 70.98 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.337 -176.504 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.52 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.32 -45.17 61.13 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.11 -33.44 73.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.762 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.497 ' HB2' ' CD2' ' A' ' 44' ' ' LEU . 41.6 tt0 -58.89 -46.49 87.73 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.344 177.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.553 ' O ' HG22 ' A' ' 54' ' ' VAL . 16.0 mmt180 -63.21 -43.36 98.34 Favored 'General case' 0 C--O 1.185 -2.304 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.267 177.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.539 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.45 -42.15 86.74 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 123.739 0.649 . . . . 0.0 111.58 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -64.31 -44.98 89.91 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.162 176.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.452 HD13 ' HA ' ' A' ' 53' ' ' ILE . 8.6 mm -71.5 -41.73 72.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.319 -179.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.553 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -67.21 -35.64 74.66 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.768 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.835 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.01 -43.32 91.52 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 118.558 0.617 . . . . 0.0 110.277 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.609 ' HG ' ' N ' ' A' ' 57' ' ' GLN . 0.1 OUTLIER -63.23 -41.91 99.16 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.776 176.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.609 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 52.0 mt-30 -72.51 -31.27 65.2 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.742 178.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.474 HD13 HD13 ' A' ' 113' ' ' ILE . 73.3 mt -64.51 -47.0 91.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 123.147 0.279 . . . . 0.0 110.447 176.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.46 -41.39 84.76 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.231 -0.588 . . . . 0.0 110.701 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.459 ' OD2' HD12 ' A' ' 56' ' ' LEU . 69.3 m-20 -69.1 -33.61 73.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.176 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.541 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -65.92 -45.0 83.52 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 173.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 m -65.51 -35.73 81.73 Favored 'General case' 0 N--CA 1.433 -1.321 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.496 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.84 -42.75 76.23 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 122.055 0.931 . . . . 0.0 108.505 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.541 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.85 -47.72 83.75 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 113.837 -1.528 . . . . 0.0 111.871 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.412 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.23 -28.84 63.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.818 177.028 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -67.95 -47.17 69.39 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.496 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.48 14.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.916 -0.714 . . . . 0.0 112.858 -177.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.78 29.41 10.73 Favored Glycine 0 C--N 1.316 -0.575 0 C-N-CA 119.809 -1.186 . . . . 0.0 111.267 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.43 92.11 6.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.227 0.537 . . . . 0.0 110.138 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.2 tp . . . . . 0 N--CA 1.463 0.201 0 CA-C-O 120.817 0.341 . . . . 0.0 111.024 179.954 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.435 -1.179 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.23 -52.44 16.41 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.191 -0.943 . . . . 0.0 109.603 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.456 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.4 mp0 -53.33 -51.75 61.37 Favored 'General case' 0 CA--C 1.503 -0.836 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.629 -178.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.62 -38.71 87.5 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 113.417 -1.719 . . . . 0.0 110.686 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.526 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.99 -44.45 94.5 Favored 'General case' 0 CA--C 1.511 -0.528 0 O-C-N 123.209 0.318 . . . . 0.0 110.363 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.717 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.4 m -68.99 -50.08 52.11 Favored 'General case' 0 N--CA 1.428 -1.54 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.629 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.44 -41.32 93.61 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -175.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.02 -39.1 89.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.547 0.213 . . . . 0.0 110.432 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.532 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.22 -40.15 89.13 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.717 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.7 mt -63.99 -41.02 97.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.641 178.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.06 -34.39 78.3 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.798 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.4 -34.36 74.37 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 177.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.46 -48.76 76.36 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 175.502 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.54 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.37 -45.41 94.49 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.405 179.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.28 -37.47 85.65 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.939 -178.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.76 -43.81 85.7 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.5 mt -72.17 -38.58 69.1 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.749 177.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.54 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.0 mm -57.49 -50.79 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 110.507 -0.182 . . . . 0.0 110.507 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.9 m -60.84 -39.37 88.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.212 0.529 . . . . 0.0 110.523 -179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.609 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -68.0 -49.59 60.66 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.02 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.3 -37.21 84.88 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.5 t -65.41 -36.9 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-O 121.171 0.51 . . . . 0.0 109.657 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.69 -40.69 79.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.2 0.524 . . . . 0.0 110.238 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.0 mt -71.41 -40.56 70.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.118 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.66 111.14 12.43 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.957 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.73 -22.64 36.97 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.78 2.32 . . . . 0.0 112.545 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.38 0.23 55.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.337 0.589 . . . . 0.0 111.151 -177.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -65.02 134.63 54.29 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.623 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.34 109.17 62.91 Favored Pre-proline 0 CA--C 1.509 -0.622 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.276 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -68.31 157.97 59.53 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.317 2.011 . . . . 0.0 111.456 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.69 154.44 25.73 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 123.634 2.889 . . . . 0.0 111.711 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.95 -30.41 69.7 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -173.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -85.54 3.49 40.31 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 123.716 0.635 . . . . 0.0 111.481 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 33.2 t80 . . . . . 0 C--N 1.333 -0.128 0 CA-C-O 120.875 0.369 . . . . 0.0 110.644 178.686 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.635 0.181 . . . . 0.0 111.699 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 375' ' ' THR . . . . . 0.46 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -126.29 -71.35 0.69 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.165 -174.72 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 376' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.9 0.01 OUTLIER 'General case' 0 C--O 1.231 0.095 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 377' ' ' VAL . . . . . 0.561 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.7 150.89 8.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.458 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 378' ' ' LEU . . . . . 0.626 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.57 152.53 20.86 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.276 -179.078 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 379' ' ' CYS . . . . . 0.609 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.49 142.53 46.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.684 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.508 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.71 101.84 5.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.953 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 2.6 tmm? -117.86 166.49 12.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.45 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 382' ' ' ASN . . . . . 0.524 HD21 HE22 ' A' ' 57' ' ' GLN . 13.2 t30 57.8 51.18 9.52 Favored 'General case' 0 CA--C 1.528 0.105 0 O-C-N 123.599 0.562 . . . . 0.0 111.415 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 383' ' ' MET . . . . . 0.812 ' HB3' HG12 ' B' ' 459' ' ' VAL . 3.0 ptm -164.85 14.33 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.236 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 384' ' ' VAL . . . . . 0.743 HG21 HG23 ' B' ' 432' ' ' ILE . 0.4 OUTLIER -152.27 125.17 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.86 0.362 . . . . 0.0 111.308 179.876 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.72 151.76 43.05 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.396 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.16 -23.47 73.05 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.286 1.991 . . . . 0.0 112.294 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.91 -5.52 53.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.45 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.69 5.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.928 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 389' ' ' LEU . . . . . 0.477 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.595 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 390' ' ' LEU . . . . . 0.557 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.62 -15.69 5.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.605 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.3 148.83 23.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.606 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -73.64 -30.23 62.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.16 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.33 -47.61 26.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.997 0.427 . . . . 0.0 110.833 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.59 -44.23 91.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.841 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.37 -59.43 4.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.181 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -27.25 61.5 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.196 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.2 -41.05 67.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.401 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 398' ' ' ILE . . . . . 0.496 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.83 -53.65 16.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.542 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 399' ' ' VAL . . . . . 0.62 HG22 HD12 ' B' ' 417' ' ' ILE . 59.7 t -53.32 -46.91 58.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.817 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.5 -59.94 3.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.526 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.67 -57.14 11.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.369 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.13 -32.88 15.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.303 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 403' ' ' ARG . . . . . 0.46 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.19 -57.36 4.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.751 0.31 . . . . 0.0 111.166 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.92 -33.66 64.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.171 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 405' ' ' GLU . . . . . 0.552 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.43 -47.1 44.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.83 -23.96 67.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.13 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.14 30.28 1.12 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.932 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.08 -17.06 12.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.74 -15.45 14.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.558 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.19 -139.45 4.15 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.573 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.24 132.46 56.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.697 0.284 . . . . 0.0 111.113 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 412' ' ' VAL . . . . . 0.424 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.39 115.48 48.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.012 0.434 . . . . 0.0 110.543 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . 0.703 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.6 -61.96 2.06 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.248 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.04 -169.43 3.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.103 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 415' ' ' ILE . . . . . 0.616 HG23 HG12 ' B' ' 434' ' ' VAL . 48.3 mt -145.05 128.96 12.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.849 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 416' ' ' GLU . . . . . 0.422 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.91 108.84 18.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.702 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 417' ' ' ILE . . . . . 1.0 HG23 HG21 ' B' ' 432' ' ' ILE . 60.7 mt -128.52 108.62 19.07 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.637 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 418' ' ' PRO . . . . . 0.629 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.49 147.56 9.0 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.709 2.273 . . . . 0.0 112.87 -179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 419' ' ' ARG . . . . . 0.557 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.89 74.64 21.97 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.194 179.875 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -47.14 117.04 1.99 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.739 2.293 . . . . 0.0 112.504 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 421' ' ' VAL . . . . . 0.598 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.7 t -74.28 97.8 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.22 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.57 21.74 8.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.482 0.658 . . . . 0.0 109.348 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 423' ' ' GLY . . . . . 0.645 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.4 29.21 6.07 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.263 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 424' ' ' VAL . . . . . 0.598 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.45 -37.59 30.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.83 35.9 4.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.844 0.355 . . . . 0.0 111.849 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 426' ' ' VAL . . . . . 0.675 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.22 -44.75 49.35 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.839 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 427' ' ' PRO . . . . . 0.675 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.1 Cg_endo -66.33 77.16 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.537 2.158 . . . . 0.0 111.018 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.21 -15.43 3.23 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.367 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.5 149.37 50.26 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.615 0.245 . . . . 0.0 110.79 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.15 5.06 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.838 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.52 126.1 44.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.899 0.38 . . . . 0.0 111.0 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 432' ' ' ILE . . . . . 1.0 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -130.98 172.92 15.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.256 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 433' ' ' PHE . . . . . 0.609 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.34 2.79 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.954 -178.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 434' ' ' VAL . . . . . 0.616 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.85 141.73 41.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.188 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 435' ' ' GLU . . . . . 0.485 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.41 108.53 17.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.752 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.83 168.39 12.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.256 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 437' ' ' THR . . . . . 0.703 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -94.97 -45.4 7.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.451 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.87 146.67 52.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.07 0.462 . . . . 0.0 111.26 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.21 -12.77 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.165 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.62 -54.8 26.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.09 0.471 . . . . 0.0 110.096 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.14 -29.52 60.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.818 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.22 -31.68 72.26 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.22 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.66 -48.0 15.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.682 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.62 -12.03 59.52 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.738 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -55.28 3.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.949 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 446' ' ' MET . . . . . 0.626 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.2 OUTLIER -64.83 -26.6 68.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.199 -179.313 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.16 -16.2 63.06 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.588 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.62 -8.63 22.52 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.354 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 449' ' ' LEU . . . . . 0.403 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.3 mt -95.69 -20.76 18.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.726 0.298 . . . . 0.0 110.898 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 15.8 p -73.95 126.73 31.1 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.063 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 98.35 -9.06 62.77 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.978 178.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 452' ' ' ARG . . . . . 0.419 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -76.59 -152.21 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.787 0.293 . . . . 0.0 110.505 177.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 453' ' ' LYS . . . . . 0.475 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.1 2.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.768 0.318 . . . . 0.0 111.296 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.35 -36.29 75.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.515 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.26 -50.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.3 24.86 0.3 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.779 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 457' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.52 135.74 19.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.316 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 13.4 p -59.41 126.94 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 121.273 0.559 . . . . 0.0 111.034 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 459' ' ' VAL . . . . . 0.812 HG12 ' HB3' ' B' ' 383' ' ' MET . 3.7 m -84.86 127.82 39.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.844 -176.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 460' ' ' VAL . . . . . . . . . . . . . 47.0 t -95.45 92.55 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.063 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 67.5 p -100.25 128.01 46.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.907 0.384 . . . . 0.0 111.316 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 462' ' ' LYS . . . . . . . . . . . . . 11.7 mtmt -132.02 -159.67 0.98 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.038 -178.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -113.32 147.02 38.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.53 -179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 464' ' ' CYS . . . . . 0.561 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.88 149.0 47.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.049 0.452 . . . . 0.0 111.311 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 465' ' ' ASP . . . . . 0.46 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.33 129.34 66.86 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.405 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 466' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.09 -33.21 72.88 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.708 2.272 . . . . 0.0 112.095 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.06 -58.55 7.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.37 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.33 -33.81 68.11 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.291 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 469' ' ' TYR . . . . . 0.485 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.5 t80 -60.12 -51.18 70.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.162 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.42 -47.5 69.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.326 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 471' ' ' ARG . . . . . 0.455 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.17 49.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.39 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.11 20.8 8.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.888 0.375 . . . . 0.0 110.215 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 473' ' ' ASP . . . . . 0.455 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.72 -20.94 24.56 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.978 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 16.6 t80 . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 121.23 0.538 . . . . 0.0 110.541 178.289 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.1 p90 . . . . . 0 CA--C 1.531 0.235 0 N-CA-C 110.545 -0.169 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.77 115.49 2.52 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.664 2.243 . . . . 0.0 112.384 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.98 -166.76 1.33 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.904 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.34 51.97 12.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.41 -36.15 3.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.002 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.79 91.85 2.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.863 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.93 -54.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.799 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.87 111.13 13.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.005 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.93 125.69 25.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.735 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.67 12.73 19.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.961 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.612 ' HZ3' HG11 ' B' ' 459' ' ' VAL . 71.6 m95 -141.97 52.97 1.48 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.766 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.15 -156.59 0.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.928 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.478 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.3 -37.65 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.76 121.26 42.76 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 118.951 -0.547 . . . . 0.0 110.64 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.3 p . . . . . 0 C--N 1.325 -0.461 0 O-C-N 123.266 0.353 . . . . 0.0 110.904 -179.622 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.429 ' HG ' ' N ' ' A' ' 45' ' ' THR . 1.5 pt? . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 120.72 0.295 . . . . 0.0 110.968 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.596 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 40.3 p -119.35 170.04 9.47 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.493 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.526 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.0 -31.32 71.68 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.297 178.74 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.596 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.32 -44.99 61.89 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.43 -33.27 72.72 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.631 -176.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -57.8 -48.23 80.3 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.095 176.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.554 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.62 -43.41 98.88 Favored 'General case' 0 C--O 1.186 -2.285 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.236 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.546 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.44 -40.08 81.57 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.782 0.676 . . . . 0.0 111.557 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -67.57 -45.79 74.55 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.021 175.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.606 HG23 HG21 ' B' ' 460' ' ' VAL . 95.8 mt -61.68 -49.14 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 177.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 50' ' ' ARG . 34.9 m -67.51 -35.54 73.55 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.776 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.916 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.15 -44.58 92.09 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.568 0.622 . . . . 0.0 110.319 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.5 tp -65.29 -35.36 80.77 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.976 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -75.12 -34.6 61.71 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.656 176.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.463 HD13 HD13 ' A' ' 113' ' ' ILE . 72.8 mt -63.05 -46.91 94.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.401 0.68 . . . . 0.0 110.433 177.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.41 -41.39 84.94 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.668 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -67.68 -34.01 76.06 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.404 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.529 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.48 -45.02 77.12 Favored 'General case' 0 C--O 1.207 -1.181 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 174.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.1 m -65.43 -35.86 82.2 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.498 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.8 -42.73 76.04 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.054 0.931 . . . . 0.0 108.529 176.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.529 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.84 -47.77 83.59 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 113.833 -1.53 . . . . 0.0 111.871 179.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.17 -28.92 63.54 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.758 177.093 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.91 -47.16 69.53 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.498 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.09 -17.52 14.46 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.75 29.47 10.68 Favored Glycine 0 C--N 1.315 -0.605 0 C-N-CA 119.858 -1.163 . . . . 0.0 111.259 -177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.4 92.07 6.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.185 0.517 . . . . 0.0 110.165 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 18.3 tp . . . . . 0 C--N 1.325 -0.464 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.503 179.141 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.2 t . . . . . 0 N--CA 1.436 -1.138 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.19 -52.43 16.55 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.329 -0.857 . . . . 0.0 109.693 -178.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.464 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.5 mp0 -53.27 -51.83 60.98 Favored 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 113.655 -1.611 . . . . 0.0 110.633 -178.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -66.67 -38.64 87.24 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.686 -177.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.96 -44.46 94.42 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 123.197 0.311 . . . . 0.0 110.385 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.711 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.9 m -69.06 -50.04 51.98 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.617 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.4 -41.28 93.82 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.95 -39.23 90.27 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 178.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.535 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.27 -40.06 89.04 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.711 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.4 mt -64.07 -40.94 97.37 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.648 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.12 -34.3 78.08 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.75 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.5 -34.39 74.23 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.4 -48.81 76.29 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.561 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.3 -45.55 94.01 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.39 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.14 -37.47 85.31 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 123.594 0.758 . . . . 0.0 111.004 -178.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.85 -43.76 86.13 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.4 mt -72.23 -38.57 68.92 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.773 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.561 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.38 -50.9 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 N-CA-C 110.514 -0.18 . . . . 0.0 110.514 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.7 m -60.71 -39.46 88.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.276 0.56 . . . . 0.0 110.551 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -68.0 -49.51 61.16 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.97 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.11 84.49 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -177.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.63 -36.85 78.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.53 -40.72 80.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.257 0.551 . . . . 0.0 110.299 177.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.5 mt -71.52 -40.6 70.0 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.982 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.64 111.23 12.47 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 116.3 -0.409 . . . . 0.0 109.929 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.78 -22.61 36.66 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.779 2.319 . . . . 0.0 112.62 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.29 0.06 55.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.409 0.623 . . . . 0.0 111.179 -177.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.91 134.64 54.42 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.606 -178.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.39 109.13 62.86 Favored Pre-proline 0 CA--C 1.509 -0.619 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.278 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.31 157.95 59.65 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.306 2.004 . . . . 0.0 111.507 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.67 154.52 25.35 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 123.589 2.859 . . . . 0.0 111.724 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.11 70.57 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -173.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -86.15 32.89 0.61 Allowed 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.765 0.666 . . . . 0.0 111.626 -177.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 9.3 p90 . . . . . 0 C--O 1.233 0.191 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.591 177.89 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 C--O 1.233 0.254 0 CA-C-O 120.964 0.319 . . . . 0.0 112.696 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 375' ' ' THR . . . . . 0.463 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -129.5 -71.32 0.62 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.217 179.161 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 376' ' ' GLU . . . . . 0.495 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.93 0.01 OUTLIER 'General case' 0 C--O 1.232 0.133 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 377' ' ' VAL . . . . . 0.56 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.62 150.99 7.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.402 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 378' ' ' LEU . . . . . 0.506 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.67 152.51 20.82 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.17 -179.085 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 379' ' ' CYS . . . . . 0.584 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.53 142.53 46.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.662 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.513 HD11 HG13 ' B' ' 434' ' ' VAL . 5.4 mt -132.71 101.9 5.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.96 -179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 91.4 mtp -117.36 166.89 11.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.849 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 57.46 51.2 10.08 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 123.649 0.593 . . . . 0.0 111.273 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 383' ' ' MET . . . . . 0.438 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.83 14.4 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.228 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 384' ' ' VAL . . . . . 0.697 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.25 125.06 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.721 0.296 . . . . 0.0 111.394 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.404 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.72 151.77 43.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.431 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.23 -23.43 72.57 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.351 2.034 . . . . 0.0 112.237 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.95 -5.51 53.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.477 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.73 5.78 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.888 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 389' ' ' LEU . . . . . 0.472 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.87 34.86 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.932 0.396 . . . . 0.0 110.607 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 390' ' ' LEU . . . . . 0.544 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.51 -15.76 5.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.674 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.29 148.74 23.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.551 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -73.58 -30.27 62.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.168 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 32.8 mm-40 -75.25 -47.76 26.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.998 0.428 . . . . 0.0 110.743 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.54 -44.25 91.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.826 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.37 -59.37 5.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.214 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.29 61.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.203 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.14 -41.02 67.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.402 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 398' ' ' ILE . . . . . 0.494 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.94 -53.69 15.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.474 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 399' ' ' VAL . . . . . 0.614 HG22 HD12 ' B' ' 417' ' ' ILE . 59.5 t -53.22 -46.98 57.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.801 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.92 3.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.517 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.73 -57.16 11.84 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.331 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.1 -32.84 15.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.385 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 403' ' ' ARG . . . . . 0.451 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.27 -57.39 4.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.12 -179.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.92 -33.59 64.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.15 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 405' ' ' GLU . . . . . 0.535 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.41 -47.17 44.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.95 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.78 -24.0 67.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.163 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.45 1.09 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.963 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.18 -17.14 12.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.821 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.66 -15.47 14.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.489 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.42 4.15 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.571 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 411' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.24 132.52 56.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.676 0.275 . . . . 0.0 111.052 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 412' ' ' VAL . . . . . 0.423 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.45 115.41 48.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.084 0.469 . . . . 0.0 110.549 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . 0.673 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.61 -62.06 1.99 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.168 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.96 -169.38 3.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.167 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 415' ' ' ILE . . . . . 0.614 HG23 HG12 ' B' ' 434' ' ' VAL . 48.5 mt -145.13 128.96 12.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.831 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 416' ' ' GLU . . . . . 0.433 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.9 108.82 18.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.733 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 417' ' ' ILE . . . . . 0.974 HG23 HG21 ' B' ' 432' ' ' ILE . 60.8 mt -128.55 108.57 19.01 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.644 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 418' ' ' PRO . . . . . 0.633 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.45 147.61 8.86 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.644 2.229 . . . . 0.0 112.916 -179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 419' ' ' ARG . . . . . 0.544 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.92 74.79 21.71 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.124 179.81 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -47.25 117.06 2.04 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.729 2.286 . . . . 0.0 112.472 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 421' ' ' VAL . . . . . 0.596 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.3 t -74.4 97.86 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.12 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.55 21.71 8.92 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.582 0.706 . . . . 0.0 109.374 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 423' ' ' GLY . . . . . 0.623 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.41 29.23 6.06 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.253 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 424' ' ' VAL . . . . . 0.596 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.48 -37.57 30.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.102 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.86 35.87 4.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.798 0.332 . . . . 0.0 111.809 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 426' ' ' VAL . . . . . 0.675 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.35 -44.68 47.72 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.775 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 427' ' ' PRO . . . . . 0.675 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.27 77.09 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.532 2.155 . . . . 0.0 111.08 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.27 -15.36 3.22 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.349 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.57 149.36 50.22 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.554 0.216 . . . . 0.0 110.864 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.17 5.06 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.842 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.4 126.04 44.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.856 0.36 . . . . 0.0 111.11 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 432' ' ' ILE . . . . . 0.974 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -130.95 172.84 15.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.28 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 433' ' ' PHE . . . . . 0.584 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.43 -176.36 2.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.981 0.419 . . . . 0.0 112.027 -178.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 434' ' ' VAL . . . . . 0.614 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.79 141.76 41.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.211 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 435' ' ' GLU . . . . . 0.492 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.36 108.39 17.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.849 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.72 168.4 12.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.255 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 437' ' ' THR . . . . . 0.673 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.91 -45.44 7.28 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.455 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.87 146.59 52.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.028 0.442 . . . . 0.0 111.249 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.15 -12.74 16.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.238 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -54.79 26.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.015 0.436 . . . . 0.0 110.087 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -75.08 -29.54 60.7 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.829 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.2 -31.71 72.27 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.197 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.61 -48.12 15.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.666 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.55 -12.11 59.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.73 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.83 -55.34 3.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.946 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 446' ' ' MET . . . . . 0.506 ' HB3' HD21 ' B' ' 378' ' ' LEU . 3.3 ptm -65.02 -25.86 68.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.22 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.8 -16.2 62.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.606 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.62 22.55 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.418 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 449' ' ' LEU . . . . . 0.407 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.66 -19.72 19.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.818 0.342 . . . . 0.0 110.99 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 16.0 m -72.85 125.94 28.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.206 -0.907 . . . . 0.0 111.038 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 98.5 -9.12 62.48 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.946 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 452' ' ' ARG . . . . . 0.433 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.83 -152.15 0.05 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.865 0.332 . . . . 0.0 110.553 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 453' ' ' LYS . . . . . 0.478 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.13 2.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.791 0.329 . . . . 0.0 111.263 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.33 -36.33 75.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.55 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.22 -50.92 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.754 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.23 24.89 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.834 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 457' ' ' ARG . . . . . 0.419 ' NE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.41 132.39 16.19 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.253 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 5.6 p -66.37 112.64 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.552 0.691 . . . . 0.0 110.994 -177.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 459' ' ' VAL . . . . . 0.612 HG11 ' HZ3' ' A' ' 22' ' ' TRP . 1.9 p -73.0 124.03 29.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.736 -174.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 460' ' ' VAL . . . . . 0.606 HG21 HG23 ' A' ' 53' ' ' ILE . 66.9 t -92.55 102.53 13.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.868 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 72.8 p -92.82 153.91 18.57 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.744 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 462' ' ' LYS . . . . . 0.41 ' HE2' ' HB2' ' B' ' 462' ' ' LYS . 0.1 OUTLIER -151.75 -168.41 3.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.082 0.468 . . . . 0.0 111.266 -177.714 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.44 146.91 37.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.411 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 464' ' ' CYS . . . . . 0.56 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 148.98 47.43 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.071 0.463 . . . . 0.0 111.363 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 465' ' ' ASP . . . . . 0.463 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.32 129.32 66.96 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.377 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 466' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.3 Cg_endo -53.96 -33.32 71.95 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.708 2.272 . . . . 0.0 112.148 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.51 7.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.385 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.81 68.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.289 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 469' ' ' TYR . . . . . 0.492 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.0 -51.28 70.33 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.161 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.38 -47.51 69.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.335 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 471' ' ' ARG . . . . . 0.448 HH11 ' HD2' ' B' ' 471' ' ' ARG . 0.0 OUTLIER -81.68 -2.18 49.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.438 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.1 20.77 8.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.007 0.432 . . . . 0.0 110.282 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 473' ' ' ASP . . . . . 0.436 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.62 -21.82 29.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.96 179.835 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 49.3 p90 . . . . . 0 N--CA 1.478 0.926 0 C-N-CA 124.652 1.181 . . . . 0.0 112.856 -175.274 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.6 p90 . . . . . 0 CA--C 1.531 0.223 0 CA-C-O 120.449 0.166 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -57.29 115.49 2.54 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.993 2.462 . . . . 0.0 112.407 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.01 -166.7 1.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.836 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.31 51.96 12.22 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.935 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.43 -36.18 3.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.996 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.92 2.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.89 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.93 -54.26 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.734 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.13 13.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.57 24.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.816 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.84 19.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.038 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.602 ' HZ3' HG21 ' B' ' 459' ' ' VAL . 71.7 m95 -142.02 53.05 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.806 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.2 -156.59 0.13 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.889 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.467 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.27 -37.7 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.454 ' O ' ' HB ' ' A' ' 26' ' ' THR . 0.2 OUTLIER -114.72 125.72 54.05 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 118.826 -0.607 . . . . 0.0 110.607 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.454 ' HB ' ' O ' ' A' ' 25' ' ' ASP . 88.3 m . . . . . 0 N--CA 1.483 1.224 0 O-C-N 124.615 1.197 . . . . 0.0 110.778 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 CA--C 1.519 -0.248 0 CA-C-O 120.998 0.428 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.587 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 1.5 p -99.38 149.15 23.46 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.334 174.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.492 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -58.64 -31.32 68.02 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.329 -178.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.587 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.33 -45.18 61.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.16 -33.1 72.88 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.761 -177.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -61.24 -44.75 96.75 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.225 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.556 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.89 -43.39 98.93 Favored 'General case' 0 C--O 1.185 -2.316 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.248 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.553 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.26 -41.09 83.5 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 123.789 0.681 . . . . 0.0 111.626 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.79 -46.8 80.57 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.024 175.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.603 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 96.5 mt -64.49 -46.94 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.013 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 50' ' ' ARG . 34.9 m -68.04 -35.59 72.3 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.806 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.914 -177.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.12 -44.22 91.98 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.515 0.598 . . . . 0.0 110.349 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 1.7 pp -70.17 -28.55 65.42 Favored 'General case' 0 C--N 1.344 0.367 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.713 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.451 ' NE2' HD21 ' B' ' 382' ' ' ASN . 91.3 mt-30 -77.86 -34.68 51.64 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 120.873 0.368 . . . . 0.0 110.167 176.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.483 HD13 HD13 ' A' ' 113' ' ' ILE . 72.5 mt -62.9 -46.94 95.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.382 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.463 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.48 -41.28 84.84 Favored 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.703 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -68.31 -33.35 74.16 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.199 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.531 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.47 -44.98 77.28 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 173.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 m -65.63 -35.61 81.29 Favored 'General case' 0 N--CA 1.433 -1.305 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -178.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.49 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.82 -42.86 76.33 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 122.068 0.937 . . . . 0.0 108.495 176.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.531 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.71 -47.78 83.72 Favored 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.873 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.418 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.18 -28.86 63.49 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.856 177.028 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -67.97 -47.12 69.45 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.5 14.46 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -177.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.43 10.76 Favored Glycine 0 C--N 1.316 -0.57 0 C-N-CA 119.916 -1.135 . . . . 0.0 111.295 -177.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.34 88.85 6.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.258 0.552 . . . . 0.0 110.094 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 26.5 tp . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.544 176.935 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.1 t . . . . . 0 N--CA 1.435 -1.201 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.16 -52.52 16.21 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.247 -0.908 . . . . 0.0 109.692 -178.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.452 ' CD ' ' H ' ' A' ' 98' ' ' GLU . 40.6 mp0 -53.3 -51.67 61.58 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.614 -1.63 . . . . 0.0 110.714 -178.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -66.78 -38.56 86.8 Favored 'General case' 0 N--CA 1.427 -1.59 0 CA-C-N 113.42 -1.718 . . . . 0.0 110.681 -177.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.523 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.89 -44.57 94.16 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.267 0.355 . . . . 0.0 110.379 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.728 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 16.0 m -69.01 -50.01 52.67 Favored 'General case' 0 N--CA 1.428 -1.561 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.649 179.027 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.449 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.4 -41.36 93.75 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -175.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.01 -39.15 90.02 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 110.381 -0.229 . . . . 0.0 110.381 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.527 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.15 -40.17 88.96 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.728 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.93 -41.02 97.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.719 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.12 -34.39 78.28 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.707 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.31 74.2 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.51 -48.84 75.95 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 175.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.554 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.32 -45.44 94.43 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.404 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.21 -37.51 85.6 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 123.603 0.761 . . . . 0.0 110.991 -178.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.84 -43.73 86.06 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.2 mt -72.21 -38.61 68.97 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.753 177.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.554 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.39 -50.86 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 120.464 0.173 . . . . 0.0 110.544 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.3 m -60.63 -39.58 88.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.221 0.534 . . . . 0.0 110.548 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.55 61.04 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.981 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.11 84.48 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.3 t -65.49 -36.88 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.19 0.519 . . . . 0.0 109.642 176.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.61 -40.77 80.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.171 0.51 . . . . 0.0 110.26 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.2 mt -71.33 -40.69 70.58 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.069 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.401 ' HA ' ' HD2' ' A' ' 121' ' ' PRO . 45.6 t30 -133.53 111.14 12.57 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.323 -0.398 . . . . 0.0 109.992 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 120' ' ' ASN . 59.9 Cg_endo -68.69 -22.72 37.06 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.885 2.39 . . . . 0.0 112.57 -178.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.24 0.04 55.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.35 0.595 . . . . 0.0 111.198 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.85 134.58 54.36 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.673 -178.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.36 109.18 62.91 Favored Pre-proline 0 CA--C 1.509 -0.615 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.308 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.29 157.97 59.52 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.247 1.965 . . . . 0.0 111.419 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.65 154.51 25.28 Favored 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 123.673 2.915 . . . . 0.0 111.737 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.31 69.38 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -173.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -85.45 34.11 0.57 Allowed 'General case' 0 CA--C 1.532 0.288 0 O-C-N 123.603 0.564 . . . . 0.0 111.224 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 56.3 t80 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.52 177.43 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 C--O 1.232 0.224 0 CA-C-O 120.523 0.135 . . . . 0.0 111.756 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 375' ' ' THR . . . . . 0.452 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -119.67 -71.33 0.74 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.124 177.903 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 376' ' ' GLU . . . . . 0.49 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.88 -45.96 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 377' ' ' VAL . . . . . 0.564 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.66 150.98 7.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.431 -179.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 378' ' ' LEU . . . . . 0.586 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.72 152.54 20.78 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.182 -179.026 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 379' ' ' CYS . . . . . 0.605 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.52 142.6 46.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.623 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.52 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.74 101.27 5.21 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.0 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 43.3 ttm -118.02 165.58 13.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.784 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 382' ' ' ASN . . . . . 0.451 HD21 ' NE2' ' A' ' 57' ' ' GLN . 13.4 t30 59.07 51.22 7.3 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 123.635 0.584 . . . . 0.0 111.273 -178.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 383' ' ' MET . . . . . 0.694 ' HB3' HG12 ' B' ' 459' ' ' VAL . 3.0 ptm -164.89 14.4 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.233 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 384' ' ' VAL . . . . . 0.744 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.3 125.09 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 0.0 111.42 179.865 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.2 mt -110.66 151.81 43.05 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.389 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -63.26 -23.49 72.39 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.293 1.995 . . . . 0.0 112.293 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.78 -5.5 53.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.552 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -110.15 -36.69 5.77 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.9 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 389' ' ' LEU . . . . . 0.481 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.99 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.997 0.427 . . . . 0.0 110.616 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.52 -15.81 5.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.652 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -98.31 148.83 23.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.565 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -73.63 -30.16 62.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.201 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.42 -47.59 26.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.001 0.429 . . . . 0.0 110.765 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.56 -44.33 91.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.748 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.27 -59.43 4.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.245 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.06 -27.31 61.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.185 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -40.99 67.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.405 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 398' ' ' ILE . . . . . 0.495 HD13 HG12 ' B' ' 384' ' ' VAL . 65.1 mt -74.88 -53.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.505 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 399' ' ' VAL . . . . . 0.621 HG22 HD12 ' B' ' 417' ' ' ILE . 59.6 t -53.31 -46.98 57.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.775 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.94 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.756 0.312 . . . . 0.0 111.548 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.65 -57.25 11.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.288 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.04 -32.9 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.391 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 403' ' ' ARG . . . . . 0.446 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.21 -57.31 4.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.824 0.345 . . . . 0.0 111.214 -179.989 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.95 -33.64 64.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.122 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 405' ' ' GLU . . . . . 0.55 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.53 -47.05 43.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.919 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.87 -23.97 67.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.148 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.07 30.41 1.09 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.981 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.15 -17.11 12.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -106.7 -15.48 14.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.535 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.37 4.12 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.627 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 411' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.26 132.51 56.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.612 0.244 . . . . 0.0 111.083 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 412' ' ' VAL . . . . . 0.422 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.51 115.47 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.101 0.477 . . . . 0.0 110.532 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . 0.7 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.8 mttt -56.6 -61.93 2.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.239 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.9 p -153.05 -169.38 3.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.171 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 415' ' ' ILE . . . . . 0.614 HG23 HG12 ' B' ' 434' ' ' VAL . 48.5 mt -145.12 128.96 12.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.848 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 416' ' ' GLU . . . . . 0.421 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.91 108.77 18.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.68 179.792 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 417' ' ' ILE . . . . . 1.006 HG23 HG21 ' B' ' 432' ' ' ILE . 60.7 mt -128.51 108.63 19.09 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.663 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 418' ' ' PRO . . . . . 0.637 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.61 147.7 9.2 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.587 2.191 . . . . 0.0 112.919 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.92 74.67 21.85 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.13 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -47.08 117.11 2.02 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.752 2.302 . . . . 0.0 112.407 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 421' ' ' VAL . . . . . 0.602 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.6 t -74.43 97.84 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.942 0.401 . . . . 0.0 111.2 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.51 21.85 9.01 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.49 0.662 . . . . 0.0 109.321 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 423' ' ' GLY . . . . . 0.649 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.28 29.26 6.09 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-N 114.755 -1.111 . . . . 0.0 111.346 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 424' ' ' VAL . . . . . 0.602 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.41 -37.6 31.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.84 35.86 4.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.817 0.342 . . . . 0.0 111.805 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 426' ' ' VAL . . . . . 0.671 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.37 -44.72 47.55 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.755 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 427' ' ' PRO . . . . . 0.671 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.24 77.11 0.33 Allowed 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.5 2.134 . . . . 0.0 111.053 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.31 -15.42 3.21 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.358 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.9 t -67.64 149.39 50.12 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.519 0.199 . . . . 0.0 110.766 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.51 -14.14 5.07 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.854 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.45 126.07 44.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.774 0.321 . . . . 0.0 111.072 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 432' ' ' ILE . . . . . 1.006 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.02 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.258 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 433' ' ' PHE . . . . . 0.605 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.38 2.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.032 0.444 . . . . 0.0 111.926 -178.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 434' ' ' VAL . . . . . 0.614 HG12 HG23 ' B' ' 415' ' ' ILE . 3.2 m -135.84 141.69 41.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.207 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 435' ' ' GLU . . . . . 0.491 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.38 108.63 17.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.833 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.82 168.41 12.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.239 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 437' ' ' THR . . . . . 0.7 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.1 p -94.93 -45.39 7.29 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.519 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.84 146.66 52.25 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.057 0.456 . . . . 0.0 111.216 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.26 -12.75 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.212 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.64 -54.86 25.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.156 0.503 . . . . 0.0 110.132 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -75.1 -29.44 60.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.859 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -31.72 72.3 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.22 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.64 -48.07 15.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.63 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.63 -12.04 59.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.762 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -56.03 3.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.914 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 446' ' ' MET . . . . . 0.586 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.6 OUTLIER -62.88 -28.07 69.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.464 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.67 -16.18 63.31 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.598 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.65 -8.59 22.51 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.408 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 449' ' ' LEU . . . . . 0.401 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.73 -19.7 19.47 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.764 0.316 . . . . 0.0 110.915 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 4.4 t -76.78 129.32 36.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.131 0.491 . . . . 0.0 110.956 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 97.08 -10.22 65.69 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.994 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 452' ' ' ARG . . . . . 0.424 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -76.09 -152.2 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 117.081 0.44 . . . . 0.0 110.492 178.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 453' ' ' LYS . . . . . 0.467 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.84 117.06 2.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.859 0.361 . . . . 0.0 111.306 -179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.17 -36.38 75.2 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.537 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.28 -50.96 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.788 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.17 24.94 0.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.704 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 457' ' ' ARG . . . . . 0.442 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.57 135.4 18.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.244 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 14.7 p -59.86 139.06 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.666 177.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 459' ' ' VAL . . . . . 0.694 HG12 ' HB3' ' B' ' 383' ' ' MET . 14.7 m -102.18 125.85 56.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.258 0.551 . . . . 0.0 111.843 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 460' ' ' VAL . . . . . 0.599 HG21 HG23 ' A' ' 53' ' ' ILE . 77.7 t -91.65 103.01 14.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.058 175.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 35.7 p -106.77 113.12 26.42 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.053 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 462' ' ' LYS . . . . . 0.408 ' HB2' ' H ' ' B' ' 463' ' ' TYR . 5.5 pttm -121.28 -157.33 0.72 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.343 0.592 . . . . 0.0 111.727 -178.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 463' ' ' TYR . . . . . 0.408 ' H ' ' HB2' ' B' ' 462' ' ' LYS . 1.3 m-85 -114.88 146.97 40.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.581 -172.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 464' ' ' CYS . . . . . 0.564 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.86 149.07 47.47 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.131 0.491 . . . . 0.0 111.284 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 465' ' ' ASP . . . . . 0.452 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.44 129.36 66.41 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.351 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 466' ' ' PRO . . . . . 0.49 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.3 Cg_endo -54.05 -33.32 72.96 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.763 2.309 . . . . 0.0 112.12 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.94 -58.52 7.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.445 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.41 -33.82 68.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.282 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 469' ' ' TYR . . . . . 0.491 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -59.96 -51.28 70.35 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.177 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.31 -47.55 69.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.358 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 471' ' ' ARG . . . . . 0.456 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.15 49.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.383 -179.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.09 20.84 8.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.917 0.389 . . . . 0.0 110.247 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 473' ' ' ASP . . . . . 0.456 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.78 -20.67 23.63 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.94 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.533 0.309 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.294 -178.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.477 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 15.0 m-85 . . . . . 0 C--O 1.231 0.092 0 N-CA-C 110.469 -0.197 . . . . 0.0 110.469 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 39.1 Cg_exo -56.54 115.53 2.54 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.287 2.658 . . . . 0.0 112.354 -173.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.01 -166.75 1.32 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.85 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.38 51.93 12.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.41 -36.23 3.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.974 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.84 2.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.92 -54.2 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.783 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.83 111.22 13.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.03 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.57 24.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.739 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.55 12.79 19.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.995 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.545 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.7 m95 -142.05 53.05 1.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.994 0.426 . . . . 0.0 110.83 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.2 -156.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.885 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.462 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.35 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.883 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.83 124.67 52.34 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-O 118.93 -0.557 . . . . 0.0 110.57 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.364 0 O-C-N 123.872 0.732 . . . . 0.0 110.041 172.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.493 ' HB3' ' HG3' ' A' ' 49' ' ' GLU . 3.8 mm? . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.769 0.318 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 54.7 p -79.19 159.07 27.53 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.506 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.11 -31.32 71.01 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 120.878 0.37 . . . . 0.0 111.305 -175.025 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -72.27 -45.12 61.48 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.3 -33.28 72.93 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.695 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.493 ' HG3' ' HB3' ' A' ' 44' ' ' LEU . 35.6 mt-10 -60.56 -45.21 94.75 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.145 177.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.556 ' O ' HG22 ' A' ' 54' ' ' VAL . 16.0 mmt180 -62.81 -43.32 99.11 Favored 'General case' 0 C--O 1.185 -2.327 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.211 177.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.541 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.42 -41.44 85.03 Favored 'General case' 0 C--N 1.32 -0.699 0 O-C-N 123.78 0.675 . . . . 0.0 111.632 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -65.3 -44.76 86.88 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.842 177.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.689 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 92.2 mt -69.18 -44.83 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.309 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.1 m -67.05 -35.49 74.66 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.71 0 CA-C-O 118.656 -0.688 . . . . 0.0 111.873 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.18 -44.77 92.17 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.595 0.634 . . . . 0.0 110.335 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 3.3 pp -72.12 -23.17 61.28 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.125 -178.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.425 ' NE2' HD21 ' B' ' 382' ' ' ASN . 48.1 mt-30 -85.86 -30.67 22.73 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.199 175.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.469 HD13 HD13 ' A' ' 113' ' ' ILE . 73.2 mt -62.59 -47.01 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.07 0.548 . . . . 0.0 110.411 172.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.483 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.34 -41.72 84.75 Favored 'General case' 0 CA--C 1.512 -0.482 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.667 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -68.53 -32.82 73.04 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.37 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.538 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.37 -45.1 77.27 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 173.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 m -65.47 -35.76 81.87 Favored 'General case' 0 N--CA 1.433 -1.288 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.499 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.73 -42.82 75.92 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.0 ttmt -61.83 -47.68 84.01 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.798 -1.546 . . . . 0.0 111.913 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.21 -28.86 63.45 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 119.758 -0.777 . . . . 0.0 111.888 176.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.92 -47.25 69.27 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.499 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.11 -17.51 14.46 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.926 -0.709 . . . . 0.0 112.904 -177.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.75 29.49 10.67 Favored Glycine 0 C--N 1.316 -0.528 0 C-N-CA 119.887 -1.149 . . . . 0.0 111.307 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.42 93.16 7.16 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.244 0.545 . . . . 0.0 110.261 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 23.3 tp . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.68 178.166 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.436 -1.138 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.19 -52.56 15.98 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.273 -0.892 . . . . 0.0 109.598 -178.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.447 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.6 mp0 -53.27 -51.75 61.27 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-N 113.616 -1.629 . . . . 0.0 110.614 -178.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.77 -38.61 86.92 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.482 -1.69 . . . . 0.0 110.626 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.53 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.92 -44.6 94.21 Favored 'General case' 0 CA--C 1.51 -0.563 0 O-C-N 123.182 0.302 . . . . 0.0 110.38 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.719 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.6 m -68.95 -50.03 52.8 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.679 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.455 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.37 -41.32 93.91 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 -175.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.97 -39.24 90.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.595 0.236 . . . . 0.0 110.373 178.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.534 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.17 -40.19 89.07 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.89 -41.08 97.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.7 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.06 -34.32 78.13 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.734 178.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.39 74.31 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 177.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.46 -48.8 76.21 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 175.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.552 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.23 -45.59 93.92 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.405 179.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.26 -37.41 85.35 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 123.579 0.751 . . . . 0.0 111.019 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.79 -43.81 85.85 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 177.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.5 mt -72.17 -38.67 69.07 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.157 -0.928 . . . . 0.0 110.75 177.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.35 -50.88 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 N-CA-C 110.488 -0.19 . . . . 0.0 110.488 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 96.0 m -60.79 -39.44 88.9 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.272 0.558 . . . . 0.0 110.589 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.614 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.88 -49.55 61.39 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.063 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.4 -37.11 84.51 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -177.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.1 t -65.57 -36.81 78.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.63 -40.78 80.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.206 0.527 . . . . 0.0 110.231 177.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.2 mt -71.4 -40.65 70.39 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.019 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.403 ' HA ' ' HD2' ' A' ' 121' ' ' PRO . 45.4 t30 -133.57 111.22 12.54 Favored Pre-proline 0 C--N 1.317 -0.834 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 120' ' ' ASN . 59.9 Cg_endo -68.79 -22.66 36.55 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.765 2.31 . . . . 0.0 112.531 -178.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.24 0.06 55.95 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.353 0.596 . . . . 0.0 111.175 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.91 134.64 54.42 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.61 -178.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.43 109.21 62.95 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.251 177.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.26 157.89 59.86 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.305 2.004 . . . . 0.0 111.516 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.57 154.5 24.88 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 123.603 2.869 . . . . 0.0 111.809 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.16 -28.59 67.42 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -173.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -71.61 -12.36 61.31 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -164.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 10.4 t80 . . . . . 0 C--N 1.327 -0.399 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.187 176.751 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.456 -0.723 0 CA-C-O 121.053 0.355 . . . . 0.0 112.363 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 375' ' ' THR . . . . . 0.456 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -127.5 -71.23 0.67 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.123 175.253 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 376' ' ' GLU . . . . . 0.481 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.85 -45.98 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 377' ' ' VAL . . . . . 0.558 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.99 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.465 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 378' ' ' LEU . . . . . 0.594 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.61 152.51 20.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.233 -179.057 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 379' ' ' CYS . . . . . 0.613 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.55 142.59 46.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.629 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.522 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.76 101.72 5.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.91 0.385 . . . . 0.0 110.958 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 85.3 mtp -119.12 166.43 12.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.97 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 382' ' ' ASN . . . . . 0.425 HD21 ' NE2' ' A' ' 57' ' ' GLN . 13.3 t30 58.7 51.26 7.88 Favored 'General case' 0 C--O 1.232 0.133 0 O-C-N 123.821 0.7 . . . . 0.0 111.345 -178.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 383' ' ' MET . . . . . 0.441 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.88 14.41 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.237 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 384' ' ' VAL . . . . . 0.739 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.3 125.01 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.382 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.413 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.61 151.78 43.01 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.468 179.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.2 -23.4 72.77 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.323 2.015 . . . . 0.0 112.279 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.9 -5.53 53.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.526 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.13 -36.71 5.77 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.848 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 389' ' ' LEU . . . . . 0.486 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.99 34.95 0.46 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.008 0.432 . . . . 0.0 110.669 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 390' ' ' LEU . . . . . 0.549 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.53 -15.72 5.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.693 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -98.34 148.77 23.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.553 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -73.55 -30.29 62.97 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.203 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -75.38 -47.58 26.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.768 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.63 -44.21 91.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.802 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.37 -59.47 4.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.193 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -27.32 61.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.234 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.17 -40.99 67.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.471 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 398' ' ' ILE . . . . . 0.489 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.91 -53.61 16.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.539 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 399' ' ' VAL . . . . . 0.613 HG22 HD12 ' B' ' 417' ' ' ILE . 59.3 t -53.4 -46.84 58.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.801 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.51 -59.94 3.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.52 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.68 -57.08 12.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.441 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.14 -32.86 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.346 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 403' ' ' ARG . . . . . 0.451 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.22 -57.42 4.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.766 0.317 . . . . 0.0 111.113 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.96 -33.68 64.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.127 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 405' ' ' GLU . . . . . 0.545 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 22.0 mm-40 -73.39 -47.02 45.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.981 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.85 -23.98 67.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.187 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.14 30.37 1.11 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.932 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.09 -17.12 12.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.45 14.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.493 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.17 -139.4 4.14 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.61 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 411' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.25 132.47 56.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.677 0.275 . . . . 0.0 111.07 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 412' ' ' VAL . . . . . 0.425 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.4 p -117.43 115.45 48.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.02 0.438 . . . . 0.0 110.653 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . 0.697 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.62 -61.97 2.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.177 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.7 p -153.07 -169.44 3.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.049 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 415' ' ' ILE . . . . . 0.615 HG23 HG12 ' B' ' 434' ' ' VAL . 48.4 mt -145.0 128.89 12.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.945 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 416' ' ' GLU . . . . . 0.419 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.84 108.79 18.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.889 0.376 . . . . 0.0 110.702 179.811 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 417' ' ' ILE . . . . . 0.966 HG23 HG21 ' B' ' 432' ' ' ILE . 60.4 mt -128.49 108.59 19.11 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.675 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 418' ' ' PRO . . . . . 0.643 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.54 147.62 9.1 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 122.669 2.246 . . . . 0.0 112.855 -179.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 419' ' ' ARG . . . . . 0.549 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.87 74.64 22.05 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.107 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.16 117.07 2.02 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.732 2.288 . . . . 0.0 112.477 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 421' ' ' VAL . . . . . 0.597 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.6 t -74.39 97.82 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.178 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.62 21.77 9.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.535 0.684 . . . . 0.0 109.298 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 423' ' ' GLY . . . . . 0.644 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.23 29.25 6.11 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.377 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 424' ' ' VAL . . . . . 0.597 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.45 -37.47 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.9 35.81 4.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.745 0.307 . . . . 0.0 111.745 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 426' ' ' VAL . . . . . 0.666 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.31 -44.69 48.1 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.792 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 427' ' ' PRO . . . . . 0.666 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.9 Cg_endo -66.25 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.491 2.128 . . . . 0.0 111.088 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.26 -15.44 3.22 Favored Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.344 -178.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.58 149.38 50.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.68 0.276 . . . . 0.0 110.771 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.13 5.06 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.845 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 431' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -125.42 126.11 44.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.836 0.351 . . . . 0.0 111.108 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 432' ' ' ILE . . . . . 0.966 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -131.06 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.231 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 433' ' ' PHE . . . . . 0.613 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.47 -176.36 2.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.982 0.42 . . . . 0.0 111.939 -178.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 434' ' ' VAL . . . . . 0.615 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.87 141.75 41.02 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.145 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 435' ' ' GLU . . . . . 0.483 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.36 108.5 17.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.845 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.76 168.29 12.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.251 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 437' ' ' THR . . . . . 0.697 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.0 p -94.86 -45.42 7.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.517 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.89 146.57 52.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.99 0.424 . . . . 0.0 111.25 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.19 -12.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.236 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -54.86 25.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.149 0.5 . . . . 0.0 110.043 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.13 -29.5 60.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.829 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.12 -31.86 72.37 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.19 179.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.61 -48.01 15.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.641 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.63 -12.02 59.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.738 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -55.73 3.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.902 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 446' ' ' MET . . . . . 0.594 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.3 OUTLIER -63.69 -27.46 69.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.25 -179.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.87 -16.33 63.23 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.574 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.64 22.53 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.425 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.2 mt -95.61 -19.52 19.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.784 0.326 . . . . 0.0 111.004 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 1.7 t -72.37 132.28 43.74 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.894 176.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 92.45 -9.55 75.78 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.299 178.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 452' ' ' ARG . . . . . 0.422 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.07 -152.25 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 117.313 0.556 . . . . 0.0 110.525 178.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 453' ' ' LYS . . . . . 0.462 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.8 117.1 2.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.884 0.373 . . . . 0.0 111.331 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.27 -36.32 75.33 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.549 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.833 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.19 24.91 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.731 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 457' ' ' ARG . . . . . 0.441 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.48 135.73 19.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.301 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 14.8 p -60.83 137.28 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.968 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 459' ' ' VAL . . . . . 0.402 HG12 HG23 ' B' ' 461' ' ' THR . 45.0 t -99.77 115.36 40.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.414 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 460' ' ' VAL . . . . . 0.592 HG21 HG23 ' A' ' 53' ' ' ILE . 39.7 t -84.88 102.76 11.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.959 176.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 461' ' ' THR . . . . . 0.402 HG23 HG12 ' B' ' 459' ' ' VAL . 21.4 p -102.68 123.13 45.8 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.377 -177.189 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 462' ' ' LYS . . . . . 0.412 ' HE2' HD11 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -130.56 -159.38 0.96 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.279 0.562 . . . . 0.0 111.758 -179.485 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -114.7 147.0 40.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.667 -171.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 464' ' ' CYS . . . . . 0.558 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.9 148.98 47.36 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.068 0.461 . . . . 0.0 111.382 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 465' ' ' ASP . . . . . 0.456 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.36 129.37 66.64 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.378 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 466' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.1 -33.24 73.14 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.677 2.251 . . . . 0.0 112.07 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.46 7.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.43 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.82 68.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.281 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 469' ' ' TYR . . . . . 0.483 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.03 -51.25 70.45 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.156 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -53.32 -47.52 69.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.4 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 471' ' ' ARG . . . . . 0.456 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.75 -2.06 49.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.415 -179.895 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.1 20.8 8.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.876 0.37 . . . . 0.0 110.236 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 473' ' ' ASP . . . . . 0.456 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.83 -19.85 19.58 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.927 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 . . . . . 0 N--CA 1.477 0.908 0 C-N-CA 123.014 0.526 . . . . 0.0 112.043 179.31 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.363 0.125 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -56.65 115.65 2.63 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 123.04 2.493 . . . . 0.0 112.205 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.0 -166.77 1.33 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.903 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.39 51.91 12.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.908 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.36 -36.18 3.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.05 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.84 91.91 2.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.87 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.89 -54.27 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.796 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.82 111.19 13.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.941 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.61 24.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.726 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.67 12.83 19.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.94 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.558 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.7 m95 -142.02 53.07 1.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.773 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.25 -156.56 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.467 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.31 -37.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.857 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.64 119.65 37.48 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.518 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.538 0.51 0 O-C-N 123.982 0.802 . . . . 0.0 109.854 -171.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 44' ' ' LEU . 3.2 mm? . . . . . 0 C--O 1.233 0.195 0 CA-C-O 121.015 0.436 . . . . 0.0 111.659 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.502 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 16.1 p -89.75 158.0 17.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.163 174.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.513 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.78 -31.43 71.63 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 120.956 0.407 . . . . 0.0 111.317 -176.107 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.502 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.27 -45.22 61.05 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -69.14 -33.03 72.8 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.796 -177.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -62.2 -42.91 99.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.419 178.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.555 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -64.03 -43.36 95.8 Favored 'General case' 0 C--O 1.185 -2.302 0 CA-C-O 118.803 -0.618 . . . . 0.0 110.274 176.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.56 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.35 -41.87 85.66 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 123.792 0.683 . . . . 0.0 111.583 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -65.73 -43.19 89.79 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.744 0.307 . . . . 0.0 110.999 176.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.779 ' HA ' HD23 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -73.22 -38.49 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.465 -178.708 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 51' ' ' ALA . 35.1 m -70.34 -35.52 62.93 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.788 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.881 177.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.13 -43.89 92.02 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.591 0.632 . . . . 0.0 110.275 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.779 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.6 OUTLIER -65.24 -34.11 77.58 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.946 178.069 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.424 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 48.8 tt0 -80.87 -29.23 35.77 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.467 HD13 HD13 ' A' ' 113' ' ' ILE . 73.0 mt -65.08 -47.06 89.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.348 174.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.4 -41.93 84.11 Favored 'General case' 0 CA--C 1.513 -0.45 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.697 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -58.84 -43.78 90.79 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 124.887 1.367 . . . . 0.0 110.843 176.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.527 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -66.01 -44.94 83.31 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.401 178.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.0 m -65.56 -35.7 81.62 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.503 ' O ' HG22 ' A' ' 67' ' ' THR . 39.3 ttp180 -55.89 -42.68 76.34 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 122.069 0.937 . . . . 0.0 108.509 176.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.527 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.84 -47.78 83.53 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.836 -1.529 . . . . 0.0 111.883 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.412 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.16 -28.91 63.54 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 119.754 -0.778 . . . . 0.0 111.791 177.069 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -68.02 -47.1 69.38 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.503 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.11 -17.59 14.43 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 120.002 -0.679 . . . . 0.0 112.821 -177.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.8 29.44 10.66 Favored Glycine 0 C--N 1.315 -0.631 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.252 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.27 92.56 6.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.174 0.511 . . . . 0.0 110.268 -179.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.437 HD11 HD21 ' A' ' 105' ' ' LEU . 3.0 mm? . . . . . 0 N--CA 1.45 -0.435 0 CA-C-N 114.009 -1.45 . . . . 0.0 109.884 175.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.436 -1.157 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.15 -52.51 16.31 Favored 'General case' 0 C--N 1.306 -1.323 0 O-C-N 121.237 -0.914 . . . . 0.0 109.604 -178.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.4 mp0 -53.19 -51.77 61.03 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.704 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.68 -38.74 87.42 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 113.355 -1.748 . . . . 0.0 110.666 -177.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.52 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.93 -44.48 94.32 Favored 'General case' 0 CA--C 1.511 -0.537 0 O-C-N 123.17 0.294 . . . . 0.0 110.384 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.731 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.7 m -68.94 -50.13 51.96 Favored 'General case' 0 N--CA 1.429 -1.521 0 C-N-CA 120.104 -0.638 . . . . 0.0 110.644 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.41 -41.27 93.76 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -175.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.9 -39.27 90.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.588 0.232 . . . . 0.0 110.384 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.527 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.2 -40.13 88.99 Favored 'General case' 0 C--O 1.225 -0.235 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.731 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.8 mt -64.04 -40.98 97.51 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.673 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.04 -34.35 78.23 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.785 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.4 74.32 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 177.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.5 -48.82 76.04 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 175.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.547 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.21 -45.54 94.16 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.396 179.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.26 -37.4 85.33 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.016 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.82 -43.8 86.0 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 66.1 mt -72.19 -38.64 69.03 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.723 177.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.44 -50.77 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-O 120.474 0.178 . . . . 0.0 110.554 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.8 m -60.79 -39.49 89.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.301 0.572 . . . . 0.0 110.544 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.601 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.9 -49.63 60.88 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.015 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.35 -37.14 84.65 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -177.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.7 t -65.54 -36.83 78.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.61 -40.79 80.23 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.23 0.538 . . . . 0.0 110.213 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.5 mt -71.41 -40.69 70.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.006 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.57 111.24 12.54 Favored Pre-proline 0 C--N 1.315 -0.894 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.011 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.76 -22.7 36.69 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.836 2.357 . . . . 0.0 112.516 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.29 0.12 55.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.379 0.609 . . . . 0.0 111.203 -177.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.86 134.62 54.43 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.66 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.4 109.08 62.81 Favored Pre-proline 0 CA--C 1.509 -0.609 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.302 177.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -68.26 157.92 59.72 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.275 1.984 . . . . 0.0 111.503 178.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.58 154.5 24.89 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 123.615 2.877 . . . . 0.0 111.786 177.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.93 -30.17 69.41 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -173.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -75.96 -13.21 60.24 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 123.451 0.469 . . . . 0.0 111.748 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 58.4 t80 . . . . . 0 N--CA 1.465 0.298 0 CA-C-O 121.0 0.429 . . . . 0.0 111.491 -179.41 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo . . . . . 0 CA--C 1.531 0.329 0 N-CA-C 113.846 0.672 . . . . 0.0 113.846 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 375' ' ' THR . . . . . 0.462 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -115.63 -71.39 0.74 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.143 173.057 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 376' ' ' GLU . . . . . 0.486 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.92 0.01 OUTLIER 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 377' ' ' VAL . . . . . 0.565 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.64 151.0 7.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.432 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 378' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.66 152.58 20.79 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.197 -179.055 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 379' ' ' CYS . . . . . 0.599 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.64 142.57 46.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.599 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.52 HD23 HG22 ' B' ' 461' ' ' THR . 5.3 mt -132.76 101.18 5.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 381' ' ' MET . . . . . 0.455 ' HB3' ' HB ' ' B' ' 460' ' ' VAL . 18.3 ttp -116.65 165.92 12.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.596 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 382' ' ' ASN . . . . . 0.493 HD21 ' NH1' ' A' ' 50' ' ' ARG . 13.3 t30 58.31 51.13 8.69 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 123.536 0.523 . . . . 0.0 111.256 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 383' ' ' MET . . . . . 0.43 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.81 14.32 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.271 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 384' ' ' VAL . . . . . 0.712 HG21 HG23 ' B' ' 432' ' ' ILE . 0.4 OUTLIER -152.3 125.13 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.829 0.347 . . . . 0.0 111.326 179.878 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.415 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.67 151.74 43.01 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.406 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.1 -23.46 73.38 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.265 1.976 . . . . 0.0 112.352 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.86 -5.53 53.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.04 -36.69 5.79 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.909 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 389' ' ' LEU . . . . . 0.473 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -83.05 34.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.946 0.403 . . . . 0.0 110.603 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 390' ' ' LEU . . . . . 0.528 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.47 -15.73 5.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.726 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -98.28 148.74 23.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.582 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -73.56 -30.34 62.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.186 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.31 -47.68 26.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.729 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.48 -44.33 91.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.801 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -56.4 -59.4 5.02 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.211 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -27.35 61.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.23 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -40.99 67.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.42 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 398' ' ' ILE . . . . . 0.496 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.9 -53.68 15.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.513 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 399' ' ' VAL . . . . . 0.628 HG22 HD12 ' B' ' 417' ' ' ILE . 59.5 t -53.34 -46.86 58.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.795 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.51 -59.92 3.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.516 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.68 -57.13 11.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.385 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.14 -32.83 15.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.375 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 403' ' ' ARG . . . . . 0.455 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.21 -57.43 4.5 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.746 0.307 . . . . 0.0 111.145 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.88 -33.64 64.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.177 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 405' ' ' GLU . . . . . 0.558 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.5 -47.02 44.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.978 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.83 -23.97 67.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.164 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.04 30.27 1.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.972 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.11 -17.07 12.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.89 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.67 -15.52 14.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.52 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.41 4.14 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.601 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 411' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.25 132.47 56.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.319 . . . . 0.0 111.086 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 412' ' ' VAL . . . . . 0.426 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.39 115.49 48.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.061 0.457 . . . . 0.0 110.593 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . 0.694 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.63 -61.98 2.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.184 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.9 p -152.96 -169.35 3.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.113 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 415' ' ' ILE . . . . . 0.615 HG23 HG12 ' B' ' 434' ' ' VAL . 48.8 mt -145.2 128.92 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.859 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 416' ' ' GLU . . . . . 0.437 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.8 108.8 18.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.746 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 417' ' ' ILE . . . . . 0.969 HG23 HG21 ' B' ' 432' ' ' ILE . 61.1 mt -128.53 108.59 19.03 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.643 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 418' ' ' PRO . . . . . 0.649 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.48 147.56 8.98 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.689 2.259 . . . . 0.0 112.903 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 419' ' ' ARG . . . . . 0.528 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.83 74.74 22.11 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.158 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -47.19 117.1 2.05 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.758 2.305 . . . . 0.0 112.475 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 421' ' ' VAL . . . . . 0.594 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.5 t -74.39 97.81 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.189 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.64 21.73 9.08 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.535 0.683 . . . . 0.0 109.29 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 423' ' ' GLY . . . . . 0.639 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.31 29.29 6.07 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.291 -179.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 424' ' ' VAL . . . . . 0.594 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.45 -37.51 30.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.17 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.85 35.78 4.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.793 0.33 . . . . 0.0 111.771 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 426' ' ' VAL . . . . . 0.675 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.32 -44.69 47.98 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.74 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 427' ' ' PRO . . . . . 0.675 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.9 Cg_endo -66.26 77.05 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.477 2.118 . . . . 0.0 111.102 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.34 -15.43 3.2 Favored Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.339 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.54 149.4 50.19 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.596 0.236 . . . . 0.0 110.729 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.5 -14.24 5.06 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.841 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.41 126.13 44.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.819 0.342 . . . . 0.0 111.024 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 432' ' ' ILE . . . . . 0.969 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.04 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.264 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 433' ' ' PHE . . . . . 0.599 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.51 -176.4 2.81 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.981 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 434' ' ' VAL . . . . . 0.615 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.73 141.74 41.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.193 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 435' ' ' GLU . . . . . 0.484 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.37 108.48 17.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.778 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.78 168.32 12.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.256 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 437' ' ' THR . . . . . 0.694 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.91 -45.34 7.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.474 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.91 146.6 52.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.004 0.431 . . . . 0.0 111.215 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.22 -12.78 16.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.215 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.54 -54.79 26.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.086 0.469 . . . . 0.0 110.189 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -75.18 -29.54 60.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.789 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 442' ' ' CYS . . . . . 0.418 ' O ' ' HG2' ' B' ' 446' ' ' MET . 0.3 OUTLIER -62.13 -31.76 72.27 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.185 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.68 -48.08 15.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.611 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.58 -11.99 59.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.776 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.86 -55.9 3.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.939 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 446' ' ' MET . . . . . 0.602 ' HB3' HD21 ' B' ' 378' ' ' LEU . 1.9 ptp -62.87 -29.17 70.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.142 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -68.41 -16.2 63.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.603 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.63 -8.62 22.52 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.367 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 449' ' ' LEU . . . . . 0.409 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.69 -19.65 19.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.711 0.291 . . . . 0.0 110.925 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 450' ' ' THR . . . . . 0.537 HG23 ' O ' ' B' ' 446' ' ' MET . 39.9 p -70.02 132.22 45.56 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.087 175.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.31 -9.19 78.08 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.384 176.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 452' ' ' ARG . . . . . 0.432 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.14 -152.2 0.04 OUTLIER 'General case' 0 C--O 1.232 0.153 0 CA-C-N 117.322 0.561 . . . . 0.0 110.517 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 453' ' ' LYS . . . . . 0.467 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.85 117.08 2.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.359 . . . . 0.0 111.324 -179.866 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.29 -36.36 75.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.494 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.21 -50.91 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.817 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.22 24.89 0.3 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.783 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 457' ' ' ARG . . . . . 0.43 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.45 136.54 19.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.253 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 8.2 p -56.47 140.17 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.994 176.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 50.7 t -101.73 121.67 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -174.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 460' ' ' VAL . . . . . 0.744 HG22 HG12 ' A' ' 53' ' ' ILE . 33.9 t -83.33 100.41 6.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.121 175.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 461' ' ' THR . . . . . 0.52 HG22 HD23 ' B' ' 380' ' ' LEU . 8.2 p -105.62 111.55 24.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.872 0.368 . . . . 0.0 110.94 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 462' ' ' LYS . . . . . 0.432 ' HB2' ' HE3' ' B' ' 462' ' ' LYS . 31.7 mtmt -117.65 -164.59 1.01 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.28 0.562 . . . . 0.0 111.271 -177.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -111.75 147.07 36.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.549 178.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 464' ' ' CYS . . . . . 0.565 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.91 148.9 47.29 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.003 0.43 . . . . 0.0 111.373 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 465' ' ' ASP . . . . . 0.462 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.35 129.43 66.41 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.366 -179.858 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 466' ' ' PRO . . . . . 0.486 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.04 -33.4 73.19 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.782 2.321 . . . . 0.0 112.035 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.99 -58.53 7.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.396 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.76 68.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.26 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 469' ' ' TYR . . . . . 0.484 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.01 -51.27 70.38 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.162 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.39 -47.54 69.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 471' ' ' ARG . . . . . 0.438 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.64 -2.16 49.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.42 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.78 8.74 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.913 0.387 . . . . 0.0 110.223 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 473' ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' B' ' 474' ' ' PHE . 0.3 OUTLIER -56.66 -20.13 19.88 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.981 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 474' ' ' PHE . . . . . 0.482 ' HB2' ' O ' ' B' ' 473' ' ' ASP . 3.3 m-30 . . . . . 0 N--CA 1.471 0.59 0 C-N-CA 123.331 0.652 . . . . 0.0 111.319 -178.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.142 0.02 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.07 115.51 2.55 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.624 2.216 . . . . 0.0 112.378 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.05 -166.77 1.32 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.4 51.93 12.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.894 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.42 -36.19 3.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.952 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.75 91.9 2.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.9 -54.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.832 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.22 13.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.96 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.99 125.56 24.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.713 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.72 19.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.024 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . 0.568 ' HZ3' HG11 ' B' ' 459' ' ' VAL . 71.8 m95 -141.97 53.09 1.48 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.798 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.2 -156.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.858 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.486 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.36 -37.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.71 120.6 40.64 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 118.956 -0.545 . . . . 0.0 110.598 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.0 p . . . . . 0 C--N 1.329 -0.316 0 O-C-N 123.63 0.581 . . . . 0.0 111.238 -178.344 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 mm? . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.723 0.297 . . . . 0.0 111.358 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.507 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.6 p -95.12 156.62 16.24 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.159 175.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.518 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.21 -31.35 71.12 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 120.889 0.376 . . . . 0.0 111.301 -174.663 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.437 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.36 -45.13 61.22 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.23 -33.05 72.69 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.731 -177.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 45' ' ' THR . 44.5 mt-10 -60.55 -45.3 94.38 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.221 177.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.552 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.05 -43.34 98.93 Favored 'General case' 0 C--O 1.185 -2.318 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.29 177.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.556 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.33 -40.77 83.01 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 123.771 0.669 . . . . 0.0 111.571 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -67.55 -46.48 72.63 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 122.175 -0.328 . . . . 0.0 110.759 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.742 HG23 HG21 ' B' ' 460' ' ' VAL . 87.2 mt -58.52 -51.16 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 110.751 176.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.556 HG22 ' HA ' ' A' ' 51' ' ' ALA . 35.0 m -66.67 -35.6 75.2 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.744 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.919 -175.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.16 -44.91 92.14 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.537 0.608 . . . . 0.0 110.312 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.487 ' HA ' ' HG2' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -70.15 -28.08 65.06 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.828 179.358 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.523 HE21 HD21 ' B' ' 382' ' ' ASN . 15.8 mt-30 -74.34 -38.49 63.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.231 174.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.481 HD13 HD13 ' A' ' 113' ' ' ILE . 72.7 mt -62.53 -47.04 94.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 114.871 -1.058 . . . . 0.0 110.374 178.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.4 -41.51 84.84 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.689 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -67.42 -34.36 77.08 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.257 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.53 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.18 -44.91 78.49 Favored 'General case' 0 C--O 1.207 -1.175 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 174.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 m -65.67 -35.72 81.58 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -178.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.497 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.76 -42.8 75.98 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 122.111 0.958 . . . . 0.0 108.516 176.181 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.53 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.79 -47.73 83.84 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 113.797 -1.547 . . . . 0.0 111.898 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.418 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.21 -28.89 63.47 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.812 177.077 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -68.05 -47.06 69.38 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.497 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.52 14.45 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.971 -0.692 . . . . 0.0 112.846 -177.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.74 29.44 10.74 Favored Glycine 0 C--N 1.315 -0.592 0 C-N-CA 119.87 -1.157 . . . . 0.0 111.285 -177.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.44 90.05 6.68 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.163 0.506 . . . . 0.0 110.147 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.0 tp . . . . . 0 C--N 1.331 -0.201 0 O-C-N 121.692 -0.63 . . . . 0.0 112.3 -170.832 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.437 -1.097 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -72.12 -52.46 16.64 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.27 -0.894 . . . . 0.0 109.7 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.463 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.5 mp0 -53.23 -51.76 61.12 Favored 'General case' 0 CA--C 1.502 -0.889 0 CA-C-N 113.612 -1.631 . . . . 0.0 110.702 -178.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.69 -38.69 87.28 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 113.428 -1.714 . . . . 0.0 110.632 -177.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . 0.529 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.95 -44.5 94.34 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 123.154 0.284 . . . . 0.0 110.369 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.718 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.3 m -68.91 -50.11 52.3 Favored 'General case' 0 N--CA 1.428 -1.538 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.677 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.451 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.41 -41.3 93.78 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -175.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.04 -39.17 89.95 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 178.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.535 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.25 -40.11 89.13 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.718 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.3 mt -63.93 -41.04 97.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.679 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.05 -34.4 78.32 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.805 178.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.48 -34.33 74.19 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 177.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.48 -48.83 76.05 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 175.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.545 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.38 -45.48 94.2 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.352 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.3 -37.4 85.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 123.53 0.732 . . . . 0.0 111.027 -178.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.83 -43.72 85.99 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.5 ' CD1' ' HB3' ' A' ' 57' ' ' GLN . 65.7 mt -72.2 -38.63 68.99 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.771 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.545 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.36 -50.86 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 CA-C-O 120.538 0.208 . . . . 0.0 110.552 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.8 m -60.72 -39.53 88.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.289 0.566 . . . . 0.0 110.529 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.608 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.54 61.12 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.024 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.34 -37.15 84.68 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -177.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.8 t -65.58 -36.83 78.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.74 80.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.245 0.545 . . . . 0.0 110.248 177.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.6 mt -71.43 -40.59 70.33 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.055 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -133.62 111.15 12.47 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.011 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.68 -22.72 37.14 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.819 2.346 . . . . 0.0 112.577 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.28 0.04 56.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.137 -177.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.89 134.64 54.44 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.627 -178.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -105.37 109.23 62.97 Favored Pre-proline 0 CA--C 1.51 -0.583 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.211 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.32 157.88 59.94 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.293 1.995 . . . . 0.0 111.553 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.63 154.51 25.14 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 123.603 2.869 . . . . 0.0 111.711 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.03 -28.46 67.41 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -173.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -73.6 -8.62 56.71 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.728 0.642 . . . . 0.0 111.868 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 87.3 t80 . . . . . 0 C--O 1.232 0.153 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 176.77 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo . . . . . 0 CA--C 1.532 0.39 0 N-CA-C 113.662 0.601 . . . . 0.0 113.662 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 375' ' ' THR . . . . . 0.464 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -117.78 -71.32 0.74 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.168 174.196 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 376' ' ' GLU . . . . . 0.49 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.88 0.01 OUTLIER 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.071 0.396 . . . . 0.0 112.071 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 377' ' ' VAL . . . . . 0.564 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.64 150.97 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.112 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.448 -179.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 378' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.65 152.51 20.83 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.179 -179.052 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 379' ' ' CYS . . . . . 0.603 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.49 142.5 46.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.636 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.518 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.73 101.64 5.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.897 0.379 . . . . 0.0 111.046 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 381' ' ' MET . . . . . 0.479 ' O ' HG23 ' B' ' 459' ' ' VAL . 27.0 ttp -117.97 165.13 14.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.604 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 382' ' ' ASN . . . . . 0.523 HD21 HE21 ' A' ' 57' ' ' GLN . 13.4 t30 58.85 51.19 7.69 Favored 'General case' 0 C--N 1.34 0.158 0 O-C-N 123.508 0.505 . . . . 0.0 111.387 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 383' ' ' MET . . . . . 0.439 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.85 14.38 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.228 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 384' ' ' VAL . . . . . 0.71 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.29 125.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.885 0.374 . . . . 0.0 111.315 179.878 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.416 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.76 151.72 43.05 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.402 179.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.15 -23.44 73.11 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.317 2.011 . . . . 0.0 112.297 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.91 -5.49 53.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.52 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.03 -36.77 5.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.911 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 389' ' ' LEU . . . . . 0.481 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.94 34.92 0.46 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.984 0.421 . . . . 0.0 110.684 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.51 -15.7 5.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.695 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.41 148.72 23.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.521 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -73.52 -30.28 63.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.176 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.28 -47.73 26.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.69 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.58 -44.3 91.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.71 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.33 -59.39 5.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.184 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.26 61.56 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.202 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.2 -41.05 67.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.39 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 398' ' ' ILE . . . . . 0.492 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.91 -53.65 16.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.5 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 399' ' ' VAL . . . . . 0.618 HG22 HD12 ' B' ' 417' ' ' ILE . 59.8 t -53.28 -46.96 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.805 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.46 -59.97 3.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.517 -179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.64 -57.18 11.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.356 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.12 -32.83 15.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.361 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 403' ' ' ARG . . . . . 0.439 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.22 -57.38 4.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.165 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.91 -33.64 64.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.198 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 405' ' ' GLU . . . . . 0.558 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.46 -47.03 44.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.963 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.84 -24.0 67.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.154 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.04 30.34 1.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.957 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.07 -17.16 12.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.93 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.72 -15.39 14.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.503 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.13 -139.43 4.16 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.574 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.26 132.46 56.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.726 0.298 . . . . 0.0 111.079 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 412' ' ' VAL . . . . . 0.424 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.38 115.46 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.052 0.453 . . . . 0.0 110.6 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . 0.665 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.62 -62.04 2.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.136 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.98 -169.36 3.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.147 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 415' ' ' ILE . . . . . 0.603 HG23 HG12 ' B' ' 434' ' ' VAL . 48.2 mt -145.1 128.97 12.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.876 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 416' ' ' GLU . . . . . 0.434 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.88 108.83 18.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.674 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 417' ' ' ILE . . . . . 0.986 HG23 HG21 ' B' ' 432' ' ' ILE . 60.5 mt -128.58 108.5 18.94 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.663 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 418' ' ' PRO . . . . . 0.63 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.47 147.62 8.9 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.621 2.214 . . . . 0.0 112.886 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.91 74.74 21.82 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.141 179.841 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -47.17 117.08 2.03 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.729 2.286 . . . . 0.0 112.497 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 421' ' ' VAL . . . . . 0.598 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.0 t -74.44 97.86 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.128 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.59 21.77 9.04 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.559 0.695 . . . . 0.0 109.358 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 423' ' ' GLY . . . . . 0.618 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.25 29.31 6.09 Favored Glycine 0 N--CA 1.444 -0.819 0 CA-C-N 114.79 -1.096 . . . . 0.0 111.306 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 424' ' ' VAL . . . . . 0.598 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.51 -37.5 30.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.152 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.92 35.93 4.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.777 0.323 . . . . 0.0 111.741 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 426' ' ' VAL . . . . . 0.666 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.37 -44.68 47.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.759 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 427' ' ' PRO . . . . . 0.666 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.34 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.488 2.125 . . . . 0.0 111.05 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.3 -15.37 3.22 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.341 -178.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.54 149.31 50.31 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.649 0.261 . . . . 0.0 110.743 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.61 -14.31 5.03 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.838 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 126.06 44.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.839 0.352 . . . . 0.0 111.111 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 432' ' ' ILE . . . . . 0.986 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -130.96 172.91 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.252 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 433' ' ' PHE . . . . . 0.603 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.37 2.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.986 0.422 . . . . 0.0 111.966 -178.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 434' ' ' VAL . . . . . 0.603 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.79 141.72 41.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.179 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 435' ' ' GLU . . . . . 0.491 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.39 108.47 17.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.836 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.74 168.35 12.56 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.205 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 437' ' ' THR . . . . . 0.665 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.96 -45.36 7.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.458 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.93 146.54 52.16 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.041 0.448 . . . . 0.0 111.25 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.14 -12.8 16.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.26 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -54.89 25.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.141 0.496 . . . . 0.0 110.121 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -75.06 -29.53 60.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.858 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -31.79 72.35 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.094 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.63 -48.08 15.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.611 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.54 -12.1 59.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.753 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -55.69 3.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.96 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 446' ' ' MET . . . . . 0.583 ' O ' HG23 ' B' ' 450' ' ' THR . 3.6 ptm -63.74 -28.15 69.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.038 -179.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.06 -16.28 63.66 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.54 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.56 -8.62 22.64 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.487 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 449' ' ' LEU . . . . . 0.4 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.3 mt -95.73 -19.87 19.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.739 0.304 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 450' ' ' THR . . . . . 0.583 HG23 ' O ' ' B' ' 446' ' ' MET . 43.2 p -70.02 131.74 44.83 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.884 175.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.81 -9.46 76.74 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.531 177.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 452' ' ' ARG . . . . . 0.424 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.15 -152.16 0.04 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 117.252 0.526 . . . . 0.0 110.505 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 453' ' ' LYS . . . . . 0.486 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.84 117.01 2.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.855 0.359 . . . . 0.0 111.34 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.17 -36.41 75.26 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.538 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.817 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.32 24.84 0.3 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.817 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 457' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.46 134.58 18.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.294 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 6.6 p -66.3 129.69 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.871 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 459' ' ' VAL . . . . . 0.568 HG11 ' HZ3' ' A' ' 22' ' ' TRP . 2.0 p -94.48 122.98 46.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.521 -175.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 460' ' ' VAL . . . . . 0.742 HG21 HG23 ' A' ' 53' ' ' ILE . 41.2 t -92.53 92.91 3.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.35 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 76.7 p -83.32 142.67 30.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.301 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 462' ' ' LYS . . . . . 0.438 ' HE2' ' HB2' ' B' ' 462' ' ' LYS . 1.3 ttmm -139.01 -164.18 1.61 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.2 0.524 . . . . 0.0 111.337 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.73 146.95 37.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.512 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 464' ' ' CYS . . . . . 0.564 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 148.99 47.45 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.999 0.428 . . . . 0.0 111.456 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 465' ' ' ASP . . . . . 0.464 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.35 129.39 66.6 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.337 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 466' ' ' PRO . . . . . 0.49 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.12 -33.22 73.26 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.655 2.236 . . . . 0.0 112.103 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.07 -58.39 8.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.453 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.51 -33.74 68.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.233 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 469' ' ' TYR . . . . . 0.491 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.07 -51.19 70.69 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.209 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.4 -47.49 69.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.332 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 471' ' ' ARG . . . . . 0.441 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.73 -2.11 49.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.399 -179.886 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.07 20.78 8.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.905 0.383 . . . . 0.0 110.285 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 473' ' ' ASP . . . . . 0.515 ' O ' ' HB2' ' B' ' 474' ' ' PHE . 0.3 OUTLIER -56.75 -20.48 22.39 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.959 179.927 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 474' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' B' ' 473' ' ' ASP . 2.8 m-30 . . . . . 0 N--CA 1.472 0.654 0 C-N-CA 123.967 0.907 . . . . 0.0 111.582 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.2 ttm . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.724 0.297 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.99 -69.2 0.66 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.546 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -125.58 -90.18 0.55 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.748 0.308 . . . . 0.0 111.699 -177.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -112.06 165.33 12.08 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.41 -178.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -119.12 141.76 48.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.92 0.391 . . . . 0.0 111.299 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -93.12 -48.64 6.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.92 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 64.56 -176.21 0.17 Allowed 'General case' 0 N--CA 1.468 0.458 0 O-C-N 123.737 0.648 . . . . 0.0 111.938 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.8 p -127.36 145.01 52.83 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.059 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.66 132.61 41.12 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.801 2.334 . . . . 0.0 111.998 176.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 98.4 mt -73.29 107.7 5.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.435 -178.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -160.44 108.1 1.6 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.661 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -84.86 141.58 38.27 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.154 178.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -56.66 115.57 2.57 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.998 2.465 . . . . 0.0 112.34 -177.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.73 1.32 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.833 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.88 12.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.917 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.38 -36.22 3.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.984 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.74 91.89 2.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.894 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.89 -54.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.838 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.85 111.21 13.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.973 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.02 125.58 24.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.755 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.76 19.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.009 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.544 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.9 m95 -141.97 53.02 1.48 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.782 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.23 -156.57 0.13 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.879 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.478 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.27 -37.72 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.87 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.76 122.69 47.17 Favored 'General case' 0 C--O 1.241 0.64 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.593 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -129.33 168.18 16.64 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 124.03 0.831 . . . . 0.0 110.399 176.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.7 tpt 74.35 -24.08 0.22 Allowed 'General case' 0 N--CA 1.473 0.708 0 O-C-N 123.736 0.648 . . . . 0.0 112.268 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -145.93 -173.08 4.06 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.671 0.272 . . . . 0.0 110.898 -178.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -78.46 143.6 36.54 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.601 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -66.11 109.03 2.44 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.609 -177.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.8 t -157.61 -27.63 0.08 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.735 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 22.0 t -85.53 103.82 12.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.297 177.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.451 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 1.0 OUTLIER -102.5 117.79 60.16 Favored Pre-proline 0 C--N 1.331 -0.238 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -173.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 33' ' ' ILE . 4.7 Cg_exo -77.63 118.52 4.56 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.111 2.541 . . . . 0.0 111.489 173.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -112.57 88.71 0.5 Allowed Glycine 0 CA--C 1.517 0.215 0 C-N-CA 120.464 -0.874 . . . . 0.0 113.15 -176.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.42 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 13.5 tpt -163.12 121.86 1.32 Allowed Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 116.518 0.159 . . . . 0.0 110.836 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 36' ' ' MET . 30.2 Cg_exo -62.58 149.02 92.45 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 122.858 2.372 . . . . 0.0 112.277 177.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.596 ' HB ' ' HA ' ' B' ' 460' ' ' VAL . 52.6 p -107.89 -26.22 10.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.661 -175.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' B' ' 461' ' ' THR . 32.9 m -55.73 139.43 14.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.004 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.797 ' H ' ' HG3' ' B' ' 462' ' ' LYS . 0.1 OUTLIER -99.11 133.26 22.28 Favored Pre-proline 0 CA--C 1.533 0.307 0 C-N-CA 119.732 -0.787 . . . . 0.0 111.36 -178.05 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' A' ' 40' ' ' ILE . 14.8 Cg_exo -68.65 152.05 74.63 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 123.586 2.857 . . . . 0.0 112.847 -176.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -80.47 105.58 1.75 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.652 2.234 . . . . 0.0 112.803 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 137.36 41.34 0.1 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.262 177.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.8 mp -127.86 -170.64 2.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.219 0.533 . . . . 0.0 111.475 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.464 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 71.5 p -119.1 162.3 18.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.159 176.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.526 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.72 -31.42 72.34 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 120.896 0.379 . . . . 0.0 111.334 -178.239 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.464 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.3 -45.21 61.01 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.08 -33.45 73.55 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.749 -177.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.711 ' HG3' HD13 ' A' ' 40' ' ' ILE . 39.6 tt0 -59.22 -46.32 88.77 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.145 -0.48 . . . . 0.0 109.998 177.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.554 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.18 -43.36 98.44 Favored 'General case' 0 C--O 1.185 -2.316 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.229 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.545 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.39 -41.41 84.81 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.765 0.666 . . . . 0.0 111.602 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -66.99 -42.79 84.44 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.024 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.691 HG23 HG21 ' B' ' 460' ' ' VAL . 96.6 mt -66.25 -49.14 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.768 177.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -65.57 -35.65 75.75 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.931 -176.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.11 -44.39 91.99 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.491 0.587 . . . . 0.0 110.372 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.3 tp -62.67 -42.01 99.39 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.807 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.527 ' HG3' ' O ' ' A' ' 53' ' ' ILE . 43.0 mt-30 -68.78 -35.67 77.34 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.641 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.485 HD13 HD13 ' A' ' 113' ' ' ILE . 73.3 mt -62.83 -47.0 94.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.431 178.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.35 -41.81 84.52 Favored 'General case' 0 CA--C 1.513 -0.47 0 C-N-CA 120.311 -0.556 . . . . 0.0 110.701 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.26 -33.15 73.83 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.441 178.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.1 -44.94 78.72 Favored 'General case' 0 C--O 1.207 -1.159 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 173.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.0 m -65.55 -35.79 81.88 Favored 'General case' 0 N--CA 1.433 -1.313 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -178.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.72 -42.83 75.89 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 122.089 0.947 . . . . 0.0 108.531 176.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.534 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.2 ttmt -61.75 -47.75 83.8 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 113.773 -1.558 . . . . 0.0 111.921 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.17 -28.89 63.51 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.788 -0.765 . . . . 0.0 111.863 177.01 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.95 -47.16 69.41 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.1 -17.52 14.46 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.966 -0.694 . . . . 0.0 112.853 -177.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.45 10.76 Favored Glycine 0 C--N 1.316 -0.53 0 C-N-CA 119.857 -1.163 . . . . 0.0 111.268 -177.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.43 91.37 6.84 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.233 0.539 . . . . 0.0 110.171 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.4 tp -101.8 -51.68 3.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 178.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.15 -94.19 1.67 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.486 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.532 HD11 HD22 ' B' ' 456' ' ' ASN . 25.2 pt -104.15 144.67 29.17 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.568 0.223 . . . . 0.0 110.953 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 72' ' ' ILE . 16.0 Cg_exo -68.46 146.35 67.98 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.693 2.262 . . . . 0.0 112.069 178.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.59 -45.57 32.92 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.863 2.375 . . . . 0.0 111.958 178.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.43 ' HA ' ' HD2' ' A' ' 76' ' ' PRO . 5.5 m-20 -123.9 96.61 42.45 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.646 176.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 75' ' ' ASN . 21.0 Cg_endo -60.82 -54.54 1.88 Allowed 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.822 2.348 . . . . 0.0 111.802 176.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -104.66 102.81 12.39 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.455 173.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -66.28 146.6 54.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.325 0.584 . . . . 0.0 111.455 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 79' ' ' ARG . 62.3 mtt-85 -81.43 -157.28 0.17 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.584 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 42.2 t -65.4 128.5 93.85 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.181 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.66 129.35 31.98 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.977 2.451 . . . . 0.0 112.777 -177.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.518 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 36.0 t -143.48 136.72 13.97 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.884 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.518 ' HD3' ' HA ' ' A' ' 82' ' ' SER . 7.0 Cg_exo -73.46 -177.62 3.16 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 123.121 2.547 . . . . 0.0 113.055 -179.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 85' ' ' PRO . 8.4 pt-20 -89.12 141.4 29.29 Favored Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.497 -178.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 84' ' ' GLU . 11.6 Cg_exo -70.9 -30.75 16.52 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.208 2.606 . . . . 0.0 112.075 176.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 6.2 tp -80.15 137.78 20.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.867 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -85.87 117.53 24.79 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.842 178.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -118.81 129.76 55.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.948 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.9 m -72.54 -52.08 17.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.622 -176.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -160.58 151.99 19.38 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.101 0.477 . . . . 0.0 111.375 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -118.79 179.2 16.83 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.419 178.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 95' ' ' ASN . 33.6 mmtp -86.01 155.15 20.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.676 0.275 . . . . 0.0 110.807 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 2.8 tpp180 -89.13 -28.56 19.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.49 178.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.93 -34.87 17.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.65 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.472 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 2.7 t-20 -117.94 120.66 38.53 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.089 -177.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -163.01 -50.15 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.772 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.1 -52.58 16.12 Favored 'General case' 0 C--N 1.305 -1.363 0 O-C-N 121.257 -0.902 . . . . 0.0 109.661 -178.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.466 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.5 mp0 -53.23 -51.77 61.1 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.623 -1.626 . . . . 0.0 110.667 -178.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -66.68 -38.68 87.29 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 113.466 -1.697 . . . . 0.0 110.659 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.535 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.9 -44.54 94.19 Favored 'General case' 0 CA--C 1.511 -0.538 0 O-C-N 123.22 0.325 . . . . 0.0 110.402 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.722 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.4 m -68.95 -50.07 52.42 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.703 178.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.455 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.34 -41.37 93.99 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.99 -39.15 90.08 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 178.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' A' ' 100' ' ' ARG . 6.2 tmtt? -60.19 -40.11 88.9 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.98 -41.05 97.64 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.657 178.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.02 -34.33 78.18 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.824 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.37 74.3 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 177.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.43 -48.86 76.03 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 175.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.552 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.29 -45.53 94.09 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 114.467 -1.242 . . . . 0.0 110.405 179.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.21 -37.42 85.28 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.564 0.746 . . . . 0.0 111.044 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.84 -43.75 86.07 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.433 HD13 ' HB2' ' A' ' 57' ' ' GLN . 65.6 mt -72.22 -38.58 68.96 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.768 177.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.47 -50.87 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 110.489 -0.189 . . . . 0.0 110.489 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.7 m -60.68 -39.5 88.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.277 0.561 . . . . 0.0 110.557 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.612 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.94 -49.6 60.86 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.005 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.37 -37.12 84.57 Favored 'General case' 0 C--O 1.217 -0.631 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.8 t -65.53 -36.81 78.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.17 0.509 . . . . 0.0 109.644 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.73 80.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.23 0.538 . . . . 0.0 110.25 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.6 mt -71.45 -40.61 70.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.023 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.63 111.2 12.47 Favored Pre-proline 0 C--N 1.317 -0.826 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.936 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.74 -22.66 36.88 Favored 'Trans proline' 0 CA--C 1.536 0.613 0 C-N-CA 122.8 2.334 . . . . 0.0 112.57 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.34 0.13 55.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.101 -177.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.97 134.68 54.44 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.616 -178.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.41 109.11 62.83 Favored Pre-proline 0 CA--C 1.509 -0.614 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.274 177.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.24 157.89 59.85 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 122.303 2.002 . . . . 0.0 111.485 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.55 154.51 24.73 Favored 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 123.603 2.868 . . . . 0.0 111.777 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.06 -32.41 72.74 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 -173.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -73.82 -24.92 59.86 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 123.895 0.747 . . . . 0.0 110.951 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -68.85 122.93 19.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.295 175.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -111.57 139.49 22.15 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.772 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.462 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 30.9 Cg_endo -64.51 136.2 49.34 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.548 2.165 . . . . 0.0 111.612 175.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 31.5 Cg_exo -60.34 169.21 5.39 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.041 2.494 . . . . 0.0 112.99 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . 70.07 113.32 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.659 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 64.9 p -78.45 -25.86 46.01 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.41 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 21.2 mmm180 70.44 160.2 0.21 Allowed 'General case' 0 N--CA 1.472 0.653 0 O-C-N 123.764 0.665 . . . . 0.0 112.181 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 16.8 m -114.54 169.76 5.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.338 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 85.6 m 65.52 -173.08 0.18 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.788 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -122.54 123.66 41.75 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.073 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.448 ' HB3' ' H ' ' A' ' 140' ' ' VAL . 9.2 mmmm 63.53 -163.04 0.27 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.75 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.448 ' H ' ' HB3' ' A' ' 139' ' ' LYS . 2.2 t -107.14 148.12 11.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.075 -177.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' MET . . . . . 0.415 ' HG2' ' H ' ' A' ' 141' ' ' MET . 4.6 ptt? -87.13 172.11 10.19 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.603 176.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 5.0 mt -112.12 116.33 49.33 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.778 -175.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -76.08 131.82 13.44 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.4 2.067 . . . . 0.0 111.804 173.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -103.56 149.66 24.68 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.103 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 26.4 t70 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.169 -0.92 . . . . 0.0 110.642 179.774 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 112.421 -0.272 . . . . 0.0 112.421 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 373' ' ' HIS . . . . . 0.611 ' H ' ' HD2' ' B' ' 374' ' ' PRO . 24.7 t60 -129.85 -47.19 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.484 0 CA-C-O 119.177 -0.44 . . . . 0.0 111.966 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 374' ' ' PRO . . . . . 0.611 ' HD2' ' H ' ' B' ' 373' ' ' HIS . 80.8 Cg_exo -50.62 129.04 25.59 Favored 'Trans proline' 0 C--N 1.364 1.356 0 C-N-CA 122.363 2.042 . . . . 0.0 113.358 178.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 375' ' ' THR . . . . . 0.462 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -117.77 -71.38 0.74 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.119 179.892 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 376' ' ' GLU . . . . . 0.495 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.91 0.01 OUTLIER 'General case' 0 C--O 1.232 0.136 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 377' ' ' VAL . . . . . 0.565 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.66 150.97 7.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 C-N-CA 120.674 -0.411 . . . . 0.0 111.431 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 378' ' ' LEU . . . . . 0.483 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.59 152.51 20.86 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.246 -179.086 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 379' ' ' CYS . . . . . 0.59 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.55 142.61 46.49 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.567 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.513 HD11 HG13 ' B' ' 434' ' ' VAL . 5.4 mt -132.79 103.13 5.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.968 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 10.3 ttt -116.86 162.79 17.17 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.194 -176.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.58 51.25 8.09 Favored 'General case' 0 C--N 1.342 0.262 0 O-C-N 123.208 0.318 . . . . 0.0 111.275 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 383' ' ' MET . . . . . 0.433 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.92 14.39 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.259 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 384' ' ' VAL . . . . . 0.707 HG21 HG23 ' B' ' 432' ' ' ILE . 0.4 OUTLIER -152.3 125.11 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.83 0.347 . . . . 0.0 111.354 179.863 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.69 151.77 43.04 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.428 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.12 -23.53 73.29 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.307 2.005 . . . . 0.0 112.315 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.85 -5.48 53.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.559 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.07 -36.7 5.78 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.901 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 389' ' ' LEU . . . . . 0.474 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.91 0.46 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 179.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 390' ' ' LEU . . . . . 0.55 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.53 -15.73 5.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.663 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -98.28 148.77 23.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.574 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -73.52 -30.26 62.98 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.21 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -75.37 -47.65 26.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.728 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.57 -44.27 91.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.768 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -56.4 -59.34 5.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.249 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.3 61.6 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.194 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.1 -41.04 67.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.412 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 398' ' ' ILE . . . . . 0.498 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.89 -53.67 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.517 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 399' ' ' VAL . . . . . 0.611 HG22 HD12 ' B' ' 417' ' ' ILE . 59.6 t -53.34 -46.91 58.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.814 -179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.99 3.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.486 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.63 -57.13 11.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.389 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.15 -32.9 16.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.33 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 403' ' ' ARG . . . . . 0.451 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.2 -57.41 4.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.706 0.288 . . . . 0.0 111.116 -179.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.98 -33.57 64.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.162 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 405' ' ' GLU . . . . . 0.544 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.5 -47.04 44.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.942 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.89 -23.88 67.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.144 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.12 30.38 1.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.961 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.13 -17.17 12.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.863 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.41 14.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.574 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.14 -139.4 4.14 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.586 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.22 132.4 56.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.678 0.275 . . . . 0.0 111.101 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 412' ' ' VAL . . . . . 0.424 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.36 115.43 48.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.01 0.433 . . . . 0.0 110.692 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . 0.68 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.63 -61.95 2.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.186 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.02 -169.4 3.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.088 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 415' ' ' ILE . . . . . 0.611 HG23 HG12 ' B' ' 434' ' ' VAL . 48.7 mt -145.12 128.98 12.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.833 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 416' ' ' GLU . . . . . 0.43 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.87 108.8 18.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.667 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 417' ' ' ILE . . . . . 0.955 HG23 HG21 ' B' ' 432' ' ' ILE . 60.9 mt -128.56 108.6 18.99 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.625 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 418' ' ' PRO . . . . . 0.634 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.6 Cg_endo -48.56 147.65 9.11 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.667 2.245 . . . . 0.0 112.866 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 419' ' ' ARG . . . . . 0.55 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.93 74.73 21.73 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.149 179.854 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -47.15 117.05 2.0 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.728 2.285 . . . . 0.0 112.491 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 421' ' ' VAL . . . . . 0.598 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.2 t -74.36 97.77 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.186 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.65 21.77 9.14 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.479 0.657 . . . . 0.0 109.32 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 423' ' ' GLY . . . . . 0.617 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.26 29.26 6.1 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.328 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 424' ' ' VAL . . . . . 0.598 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.51 -37.45 30.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.94 35.9 4.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 111.776 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 426' ' ' VAL . . . . . 0.678 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.33 -44.74 48.12 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.783 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 427' ' ' PRO . . . . . 0.678 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.29 77.08 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.497 2.131 . . . . 0.0 111.095 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.3 -15.39 3.22 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.359 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.3 t -67.54 149.38 50.22 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.573 0.225 . . . . 0.0 110.82 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.51 -14.2 5.06 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.814 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.43 126.13 44.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.871 0.367 . . . . 0.0 111.092 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 432' ' ' ILE . . . . . 0.955 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -131.05 172.87 15.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.232 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 433' ' ' PHE . . . . . 0.59 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.33 2.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.958 0.409 . . . . 0.0 112.015 -178.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 434' ' ' VAL . . . . . 0.611 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.86 141.68 41.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.18 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 435' ' ' GLU . . . . . 0.492 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.31 108.48 17.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.841 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.7 168.42 12.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.234 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 437' ' ' THR . . . . . 0.68 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -95.02 -45.34 7.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.439 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.94 146.62 52.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 111.198 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.26 -12.7 16.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.248 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.9 24.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.098 0.475 . . . . 0.0 110.078 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -75.07 -29.52 60.71 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.842 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.16 -31.74 72.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.209 179.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 443' ' ' GLN . . . . . 0.401 ' HB3' HE21 ' B' ' 443' ' ' GLN . 6.2 tt0 -78.72 -47.99 15.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.622 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.1 59.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.709 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.79 -55.76 3.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.948 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 446' ' ' MET . . . . . 0.468 ' HB3' HD21 ' B' ' 378' ' ' LEU . 4.2 ptm -63.64 -27.7 69.41 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.297 -179.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.51 -16.26 63.41 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.632 179.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.65 -8.58 22.52 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.374 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 449' ' ' LEU . . . . . 0.401 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.71 -19.02 20.02 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.813 0.34 . . . . 0.0 110.969 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 3.6 t -74.37 131.1 40.82 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.989 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.53 -9.65 73.73 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.23 178.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 452' ' ' ARG . . . . . 0.431 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -76.41 -152.23 0.04 OUTLIER 'General case' 0 C--N 1.339 0.133 0 CA-C-N 117.327 0.564 . . . . 0.0 110.495 178.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 453' ' ' LYS . . . . . 0.478 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.79 117.12 2.29 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.811 0.338 . . . . 0.0 111.292 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.2 -36.4 75.29 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.545 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.824 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 456' ' ' ASN . . . . . 0.532 HD22 HD11 ' A' ' 72' ' ' ILE . 6.4 p30 -157.29 24.93 0.3 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.771 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 457' ' ' ARG . . . . . 0.426 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.5 135.3 18.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.279 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 46.3 t -63.38 122.44 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.42 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 59.4 t -76.62 121.28 28.49 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.714 -177.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 460' ' ' VAL . . . . . 0.691 HG21 HG23 ' A' ' 53' ' ' ILE . 65.5 t -89.79 96.94 6.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.364 176.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 461' ' ' THR . . . . . 0.464 ' O ' ' HA ' ' A' ' 39' ' ' VAL . 10.3 t -91.04 153.54 20.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.661 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 462' ' ' LYS . . . . . 0.797 ' HG3' ' H ' ' A' ' 40' ' ' ILE . 2.0 ttpp -159.18 -167.52 2.09 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 121.106 0.479 . . . . 0.0 110.76 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -114.21 146.99 39.65 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 123.385 0.674 . . . . 0.0 110.452 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 464' ' ' CYS . . . . . 0.565 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.91 149.02 47.36 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.104 0.478 . . . . 0.0 111.286 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 465' ' ' ASP . . . . . 0.462 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.39 129.34 66.67 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.372 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 466' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.04 -33.32 72.84 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.75 2.3 . . . . 0.0 112.097 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.97 -58.52 7.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.441 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.36 -33.78 68.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.336 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 469' ' ' TYR . . . . . 0.492 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.0 -51.27 70.39 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.21 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.36 -47.51 69.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.367 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 471' ' ' ARG . . . . . 0.442 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.13 49.35 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.44 -179.925 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.73 8.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.942 0.401 . . . . 0.0 110.269 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 473' ' ' ASP . . . . . 0.442 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.81 -20.54 23.17 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.006 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 63.0 48.39 3.87 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 122.92 0.488 . . . . 0.0 112.017 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 50.7 m95 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.519 -0.753 . . . . 0.0 111.38 179.648 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.3 mtt . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 120.836 0.351 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.77 128.37 34.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.25 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 8.0 t -86.61 -17.5 33.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.67 177.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -179.04 165.85 35.04 Favored Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.946 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.28 76.11 8.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.08 0.467 . . . . 0.0 110.974 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -110.46 -38.16 5.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.742 -178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.73 -46.41 68.96 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.467 177.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.4 p -96.94 119.53 63.32 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.27 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.49 127.12 21.79 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.729 2.286 . . . . 0.0 112.93 -177.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 mm? 60.0 -98.82 0.09 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.426 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -128.02 -158.47 0.88 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.924 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.414 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 67.3 m-85 -68.77 140.48 91.74 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.235 177.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 38.8 Cg_exo -56.38 115.48 2.5 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 123.1 2.533 . . . . 0.0 112.458 -174.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.71 1.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.846 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.38 51.93 12.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.913 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.37 -36.24 3.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.992 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.71 91.86 2.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.86 -54.26 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.83 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.79 111.2 13.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.039 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.05 125.6 25.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.693 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 21' ' ' ARG . 0.9 OUTLIER -112.58 12.75 19.92 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.01 -179.805 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.554 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.9 m95 -141.98 53.11 1.48 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.731 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -156.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.84 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.477 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.37 -37.6 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.91 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.65 113.49 24.41 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.246 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.837 HG23 ' H ' ' A' ' 27' ' ' MET . 1.8 t 174.7 -93.38 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -175.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.837 ' H ' HG23 ' A' ' 26' ' ' THR . 3.0 mtm -68.66 -46.74 68.31 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-O 120.653 0.263 . . . . 0.0 110.325 -179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 64.82 93.04 0.07 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.377 175.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.3 tt0 -133.66 -69.51 0.54 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.133 176.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.425 ' HE2' ' NE2' ' A' ' 57' ' ' GLN . 47.4 mtpt -101.27 91.49 4.53 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 175.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.2 p -89.41 154.53 19.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.932 -0.577 . . . . 0.0 112.55 -173.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.866 HG11 ' HA2' ' B' ' 451' ' ' GLY . 4.9 p -128.73 145.51 35.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.953 170.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.447 HG12 ' HD2' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -95.07 130.32 33.0 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 177.315 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.447 ' HD2' HG12 ' A' ' 33' ' ' ILE . 11.2 Cg_endo -55.07 118.96 5.74 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.056 2.504 . . . . 0.0 112.742 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.82 -27.75 4.55 Favored Glycine 0 N--CA 1.453 -0.216 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.976 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 25.0 mmt -99.48 123.24 48.9 Favored Pre-proline 0 C--N 1.332 -0.188 0 CA-C-O 120.653 0.263 . . . . 0.0 110.554 178.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.592 ' HB2' HG22 ' A' ' 39' ' ' VAL . 60.5 Cg_endo -72.93 156.23 52.56 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.705 2.27 . . . . 0.0 113.231 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 1.045 ' HB ' HG12 ' B' ' 460' ' ' VAL . 34.9 p -115.42 9.24 15.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.38 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.592 HG22 ' HB2' ' A' ' 37' ' ' PRO . 15.4 m -69.91 136.3 26.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.131 179.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 1.019 ' HB ' ' HD2' ' B' ' 462' ' ' LYS . 57.1 mt -105.12 119.61 52.54 Favored Pre-proline 0 C--N 1.331 -0.211 0 N-CA-C 110.233 -0.284 . . . . 0.0 110.233 178.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.465 ' HA ' ' HD3' ' A' ' 42' ' ' PRO . 12.4 Cg_endo -55.06 156.3 16.41 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.311 2.674 . . . . 0.0 113.025 -178.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 6.9 Cg_endo -82.31 107.84 1.69 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.949 2.433 . . . . 0.0 112.591 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 135.71 29.95 0.35 Allowed Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.795 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -111.19 139.17 46.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.655 0.264 . . . . 0.0 111.593 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 48.5 p -77.56 157.92 30.1 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 173.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.613 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -63.36 -31.32 72.44 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 120.856 0.36 . . . . 0.0 111.319 -173.511 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -72.38 -45.04 61.58 Favored 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.3 -32.83 72.24 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.735 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.613 ' HG2' ' O ' ' A' ' 46' ' ' ARG . 20.2 pt-20 -66.84 -38.3 86.13 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.028 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.559 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.99 -43.34 96.01 Favored 'General case' 0 C--O 1.185 -2.338 0 CA-C-O 118.877 -0.583 . . . . 0.0 110.25 174.443 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.537 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.43 -41.95 86.21 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 123.794 0.684 . . . . 0.0 111.597 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -64.21 -48.12 77.08 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.834 175.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.699 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 63.5 mt -60.61 -51.8 68.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 120.872 0.368 . . . . 0.0 110.802 177.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.559 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -64.77 -35.62 75.48 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.789 0 CA-C-O 118.67 -0.681 . . . . 0.0 111.919 -174.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.01 -44.31 91.66 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.566 0.621 . . . . 0.0 110.317 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 2.2 pp -71.35 -28.19 63.89 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.884 179.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.619 ' HG2' ' O ' ' A' ' 53' ' ' ILE . 14.2 mm-40 -74.51 -36.25 63.22 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 174.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.48 HD13 HD13 ' A' ' 113' ' ' ILE . 72.9 mt -63.21 -46.97 94.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.404 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.49 -40.86 85.22 Favored 'General case' 0 CA--C 1.513 -0.476 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.7 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.496 ' OD2' ' HA ' ' A' ' 32' ' ' VAL . 84.5 m-20 -71.67 -30.25 65.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.321 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.542 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.51 -44.93 77.22 Favored 'General case' 0 C--O 1.208 -1.131 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 171.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.62 -35.79 81.82 Favored 'General case' 0 N--CA 1.432 -1.343 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.5 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.84 -42.7 76.16 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 176.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.542 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.81 -47.82 83.38 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 113.856 -1.52 . . . . 0.0 111.848 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.416 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.12 -28.91 63.58 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.883 177.024 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -67.98 -47.14 69.38 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.5 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.1 -17.49 14.47 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.916 0.709 . . . . 0.0 112.916 -177.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.47 10.73 Favored Glycine 0 C--N 1.316 -0.565 0 C-N-CA 119.884 -1.151 . . . . 0.0 111.29 -177.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.39 91.42 6.83 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.229 0.538 . . . . 0.0 110.24 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.85 12.84 17.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.626 177.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 142.29 -6.77 2.26 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.031 -177.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.459 ' HB ' ' HD2' ' A' ' 73' ' ' PRO . 39.1 pt -98.08 160.38 28.5 Favored Pre-proline 0 C--N 1.331 -0.221 0 C-N-CA 122.169 0.188 . . . . 0.0 110.939 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.459 ' HD2' ' HB ' ' A' ' 72' ' ' ILE . 24.2 Cg_endo -63.38 131.56 32.48 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.627 2.218 . . . . 0.0 112.358 177.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.78 141.37 96.69 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.27 2.647 . . . . 0.0 112.899 -178.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.8 m120 58.65 71.38 1.0 Allowed Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 115.45 -0.796 . . . . 0.0 112.148 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -81.59 -15.25 9.86 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.413 2.075 . . . . 0.0 112.15 176.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.61 170.92 15.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.695 179.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -160.11 -44.03 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.93 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -94.58 96.67 9.6 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.887 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.5 m -150.14 107.35 3.19 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.223 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -72.37 133.86 21.65 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.866 2.377 . . . . 0.0 111.932 176.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.411 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 66.6 p -115.0 115.14 43.42 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 120.874 0.369 . . . . 0.0 111.842 -177.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 82' ' ' SER . 5.0 Cg_exo -75.72 134.09 16.26 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.174 2.583 . . . . 0.0 111.968 176.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -130.75 106.21 15.48 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-O 120.843 0.354 . . . . 0.0 111.361 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -79.75 117.28 3.61 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.984 2.456 . . . . 0.0 111.374 174.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.9 mm -73.98 134.95 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.713 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 27.7 t80 69.12 92.73 0.08 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.906 0.754 . . . . 0.0 110.756 -177.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -80.59 110.5 16.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.392 -177.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 42.9 t -74.78 -31.43 61.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.818 177.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -99.48 107.2 19.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.659 178.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -96.83 83.76 0.78 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.234 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 50.0 pttt -141.31 152.51 44.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.815 0.34 . . . . 0.0 111.257 -176.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -95.77 -57.43 2.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.939 -179.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 55.7 mt 74.94 -15.14 0.68 Allowed 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 174.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -84.52 131.76 34.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.166 0.508 . . . . 0.0 111.65 -175.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -122.42 -50.23 2.0 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.711 173.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.1 -52.5 16.47 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.226 -0.922 . . . . 0.0 109.659 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.461 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.4 mp0 -53.32 -51.7 61.55 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 113.677 -1.602 . . . . 0.0 110.659 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -66.73 -38.63 87.05 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.498 -1.683 . . . . 0.0 110.678 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.95 -44.55 94.33 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.177 0.298 . . . . 0.0 110.307 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.704 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.8 m -69.01 -49.99 52.77 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.691 179.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.454 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.43 -41.28 93.7 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -175.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.0 -39.07 89.98 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.533 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.29 -40.14 89.41 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.91 -41.01 97.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.736 178.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.11 -34.35 78.19 Favored 'General case' 0 C--O 1.21 -1.009 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.712 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.44 -34.34 74.27 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 177.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.54 -48.75 76.24 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 175.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.552 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.35 -45.51 94.08 Favored 'General case' 0 C--O 1.213 -0.857 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.392 179.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.27 -37.37 85.22 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.017 -178.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.91 -43.7 86.34 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 177.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.488 HD13 ' HB2' ' A' ' 57' ' ' GLN . 65.4 mt -72.28 -38.53 68.77 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.75 177.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.38 -50.85 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 120.514 0.197 . . . . 0.0 110.544 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 96.2 m -60.81 -39.46 89.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.148 0.499 . . . . 0.0 110.477 -179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.611 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.57 60.93 Favored 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.03 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.32 -37.08 84.56 Favored 'General case' 0 C--O 1.217 -0.621 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -177.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.0 t -65.59 -36.88 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.59 -40.76 80.35 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.162 0.505 . . . . 0.0 110.211 177.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 67.0 mt -71.49 -40.61 70.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.995 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.405 ' HA ' ' HD2' ' A' ' 121' ' ' PRO . 45.5 t30 -133.56 111.14 12.54 Favored Pre-proline 0 C--N 1.317 -0.837 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.001 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 120' ' ' ASN . 59.7 Cg_endo -68.72 -22.69 36.94 Favored 'Trans proline' 0 CA--C 1.536 0.579 0 C-N-CA 122.805 2.337 . . . . 0.0 112.56 -178.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.33 0.14 55.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.336 0.589 . . . . 0.0 111.121 -177.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.96 134.61 54.31 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.651 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.32 109.16 62.89 Favored Pre-proline 0 N--CA 1.446 -0.642 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.332 177.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.28 157.98 59.49 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.228 1.952 . . . . 0.0 111.473 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.66 154.47 25.47 Favored 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 123.598 2.865 . . . . 0.0 111.737 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.06 -30.25 69.4 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -173.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -73.59 -25.27 60.26 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.851 0.719 . . . . 0.0 111.791 -174.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -72.58 131.14 42.08 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.723 0.297 . . . . 0.0 110.39 177.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 7.6 pttm -141.46 130.02 12.27 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.254 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.441 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 4.5 Cg_exo -74.56 140.0 26.23 Favored 'Trans proline' 0 N--CA 1.462 -0.341 0 C-N-CA 122.813 2.342 . . . . 0.0 111.593 175.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 20.8 Cg_exo -64.88 100.26 0.35 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.176 2.584 . . . . 0.0 113.071 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -138.84 -44.22 0.48 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.046 178.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 7.3 t -132.78 -18.72 2.38 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.365 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.9 ttm180 61.21 95.88 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.854 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 18.3 t -101.46 89.46 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.622 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 8.5 p -133.82 113.86 12.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.428 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -127.43 -27.15 2.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.457 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.428 ' HD2' ' HA ' ' A' ' 139' ' ' LYS . 20.8 tptm -89.11 108.09 19.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.08 0.467 . . . . 0.0 110.845 -179.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 9.5 p -148.67 148.61 15.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.294 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 45.7 ttm -70.85 126.11 28.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.996 0.427 . . . . 0.0 111.366 -179.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 3.0 mt -97.96 106.08 31.99 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.81 175.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -68.05 153.63 74.55 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.972 2.448 . . . . 0.0 112.996 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -91.47 119.6 31.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.358 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.396 -0.811 . . . . 0.0 110.832 -178.244 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.544 -0.222 . . . . 0.0 112.544 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 373' ' ' HIS . . . . . 0.703 ' HB3' ' HD3' ' B' ' 374' ' ' PRO . 14.0 t-80 -92.67 -54.54 0.25 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-O 119.647 -0.216 . . . . 0.0 111.562 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 374' ' ' PRO . . . . . 0.703 ' HD3' ' HB3' ' B' ' 373' ' ' HIS . 13.3 Cg_exo -70.7 149.53 61.02 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.288 1.992 . . . . 0.0 113.586 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 375' ' ' THR . . . . . 0.463 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -129.01 -71.32 0.64 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.121 176.883 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 376' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.88 -45.92 0.01 OUTLIER 'General case' 0 C--O 1.232 0.172 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 377' ' ' VAL . . . . . 0.565 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.72 151.02 7.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.423 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 378' ' ' LEU . . . . . 0.472 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.7 152.57 20.78 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.207 -179.014 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 379' ' ' CYS . . . . . 0.602 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.7 t -115.56 142.61 46.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.641 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.51 HD11 HG13 ' B' ' 434' ' ' VAL . 5.4 mt -132.73 101.49 5.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.979 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 67.2 mtt -116.95 165.7 13.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.911 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 58.38 51.16 8.53 Favored 'General case' 0 CA--C 1.529 0.152 0 O-C-N 123.609 0.568 . . . . 0.0 111.324 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 383' ' ' MET . . . . . 0.442 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.87 14.43 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.235 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 384' ' ' VAL . . . . . 0.745 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.36 125.08 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.349 . . . . 0.0 111.369 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.415 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.69 151.72 43.01 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.412 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.1 -23.44 73.42 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.306 2.004 . . . . 0.0 112.342 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.93 -5.47 53.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.504 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.04 -36.8 5.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 389' ' ' LEU . . . . . 0.471 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.96 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.55 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 390' ' ' LEU . . . . . 0.557 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.54 -15.74 5.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.676 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -98.33 148.76 23.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.555 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -73.56 -30.26 62.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.218 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.39 -47.58 26.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.794 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.54 -44.27 91.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.795 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.43 -59.33 5.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.211 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -27.33 61.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.08 -41.09 67.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.418 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 398' ' ' ILE . . . . . 0.497 HD13 HG12 ' B' ' 384' ' ' VAL . 65.6 mt -74.86 -53.74 15.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.491 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 399' ' ' VAL . . . . . 0.622 HG22 HD12 ' B' ' 417' ' ' ILE . 59.8 t -53.28 -46.91 57.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.85 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.43 -59.99 3.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.5 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.65 -57.19 11.69 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.39 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.12 -32.85 15.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.333 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 403' ' ' ARG . . . . . 0.459 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.2 -57.43 4.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 111.141 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.94 -33.61 64.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.205 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 405' ' ' GLU . . . . . 0.554 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.44 -47.08 44.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.001 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.78 -24.04 67.6 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.137 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.33 1.11 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.97 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.04 -17.17 12.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.87 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -106.68 -15.38 14.77 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.594 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.15 -139.46 4.17 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.616 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 411' ' ' LEU . . . . . 0.417 ' HA ' HD13 ' B' ' 411' ' ' LEU . 1.6 mm? -114.21 132.5 56.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.645 0.259 . . . . 0.0 111.11 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 412' ' ' VAL . . . . . 0.423 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.41 115.37 48.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.007 0.432 . . . . 0.0 110.631 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . 0.703 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.59 -62.0 2.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.225 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.95 -169.35 3.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.109 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 415' ' ' ILE . . . . . 0.616 HG23 HG12 ' B' ' 434' ' ' VAL . 48.7 mt -145.13 128.99 12.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.842 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 416' ' ' GLU . . . . . 0.423 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.8 108.76 18.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.712 179.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 417' ' ' ILE . . . . . 1.018 HG23 HG21 ' B' ' 432' ' ' ILE . 60.7 mt -128.56 108.53 18.98 Favored Pre-proline 0 C--N 1.327 -0.406 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.725 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 418' ' ' PRO . . . . . 0.631 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.45 147.61 8.85 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.664 2.243 . . . . 0.0 112.965 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 419' ' ' ARG . . . . . 0.557 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.9 74.72 21.88 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.145 179.891 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.2 117.15 2.08 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.749 2.3 . . . . 0.0 112.434 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 421' ' ' VAL . . . . . 0.599 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 95.9 t -74.44 97.82 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.171 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.59 21.77 9.05 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.596 0.713 . . . . 0.0 109.353 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 423' ' ' GLY . . . . . 0.649 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.27 29.28 6.09 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.232 -179.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 424' ' ' VAL . . . . . 0.599 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.48 -37.49 30.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.94 35.81 4.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.787 0.327 . . . . 0.0 111.774 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 426' ' ' VAL . . . . . 0.671 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.26 -44.75 48.97 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.827 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 427' ' ' PRO . . . . . 0.671 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.2 Cg_endo -66.32 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.443 2.095 . . . . 0.0 111.078 179.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.29 -15.4 3.22 Favored Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.306 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.59 149.34 50.22 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.582 0.23 . . . . 0.0 110.829 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.49 -14.16 5.07 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.879 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.42 126.2 44.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 110.979 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 432' ' ' ILE . . . . . 1.018 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.06 172.94 15.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.279 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 433' ' ' PHE . . . . . 0.602 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.51 -176.42 2.81 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.968 0.413 . . . . 0.0 111.994 -178.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 434' ' ' VAL . . . . . 0.616 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.76 141.76 41.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.165 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 435' ' ' GLU . . . . . 0.483 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.7 tt0 -84.35 108.48 17.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.811 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.74 168.37 12.54 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.239 -179.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 437' ' ' THR . . . . . 0.703 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.5 p -94.96 -45.32 7.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.465 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.93 146.59 52.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.077 0.465 . . . . 0.0 111.165 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.17 -12.8 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.239 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -54.91 24.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.152 0.501 . . . . 0.0 110.083 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -75.1 -29.46 60.61 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.805 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -31.86 72.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.142 179.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.59 -47.94 16.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.703 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.7 -11.97 59.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.723 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -56.16 3.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.898 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 446' ' ' MET . . . . . 0.489 ' HE2' HG12 ' A' ' 39' ' ' VAL . 2.9 ptm -61.54 -29.71 70.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.285 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.23 -16.23 63.55 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.626 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.59 -8.63 22.57 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.443 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 449' ' ' LEU . . . . . 0.403 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.68 -19.78 19.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.806 0.336 . . . . 0.0 110.943 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 450' ' ' THR . . . . . 0.466 HG22 ' OG1' ' A' ' 38' ' ' THR . 21.8 p -70.71 130.06 40.76 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.992 175.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 451' ' ' GLY . . . . . 0.866 ' HA2' HG11 ' A' ' 32' ' ' VAL . . . 93.49 -8.9 74.59 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.578 177.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 452' ' ' ARG . . . . . 0.425 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.98 -152.2 0.05 Allowed 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 117.206 0.503 . . . . 0.0 110.531 179.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 453' ' ' LYS . . . . . 0.477 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.11 2.29 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.858 0.361 . . . . 0.0 111.326 -179.902 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.3 -36.34 75.43 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.551 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.25 -50.96 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.82 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 456' ' ' ASN . . . . . 0.773 ' HB3' ' HE3' ' A' ' 27' ' ' MET . 6.3 p30 -157.2 24.94 0.3 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.753 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 457' ' ' ARG . . . . . 0.442 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.47 133.04 16.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.309 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 458' ' ' VAL . . . . . 0.416 HG21 ' HB ' ' A' ' 32' ' ' VAL . 7.1 p -64.42 135.92 27.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 O-C-N 121.656 -0.652 . . . . 0.0 111.183 -177.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 459' ' ' VAL . . . . . 0.459 HG12 HG23 ' B' ' 461' ' ' THR . 45.1 t -91.1 121.55 41.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.167 -176.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 460' ' ' VAL . . . . . 1.045 HG12 ' HB ' ' A' ' 38' ' ' THR . 4.7 m -94.35 98.09 7.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.507 0.67 . . . . 0.0 110.488 176.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 461' ' ' THR . . . . . 0.459 HG23 HG12 ' B' ' 459' ' ' VAL . 17.0 p -97.53 128.88 44.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.122 -177.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 462' ' ' LYS . . . . . 1.019 ' HD2' ' HB ' ' A' ' 40' ' ' ILE . 5.8 ptmt -130.14 -160.5 1.04 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.742 -178.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 463' ' ' TYR . . . . . 0.426 ' H ' ' HB2' ' B' ' 462' ' ' LYS . 1.2 m-85 -114.96 147.01 40.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.59 -175.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 464' ' ' CYS . . . . . 0.565 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.92 148.98 47.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.15 0.5 . . . . 0.0 111.33 -179.901 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 465' ' ' ASP . . . . . 0.463 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.39 129.42 66.33 Favored Pre-proline 0 CA--C 1.529 0.153 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.373 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 466' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.11 -33.23 73.19 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.704 2.269 . . . . 0.0 112.06 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.53 7.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.374 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 468' ' ' SER . . . . . 0.428 ' HB3' ' HB3' ' B' ' 475' ' ' TRP . 0.8 OUTLIER -57.43 -33.77 68.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 469' ' ' TYR . . . . . 0.483 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.05 -51.21 70.61 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.221 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.31 -47.59 69.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.393 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 471' ' ' ARG . . . . . 0.45 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.65 -2.11 49.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.432 -179.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.01 20.86 8.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.924 0.393 . . . . 0.0 110.232 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 473' ' ' ASP . . . . . 0.45 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.88 -20.82 25.14 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.947 179.898 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 62.66 53.12 2.65 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.952 0.406 . . . . 0.0 111.078 -177.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 475' ' ' TRP . . . . . 0.428 ' HB3' ' HB3' ' B' ' 468' ' ' SER . 45.6 t-105 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.877 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.2 ttp . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.957 0.408 . . . . 0.0 110.532 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.66 -45.38 0.54 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.833 178.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.7 p 54.3 -164.89 0.1 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.715 0.806 . . . . 0.0 112.534 178.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 96.97 46.62 2.4 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.643 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 57.96 -109.27 0.46 Allowed 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.822 0.449 . . . . 0.0 111.617 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 70.51 133.23 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.319 0.648 . . . . 0.0 112.175 178.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.5 161.62 19.3 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.116 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.0 m -108.95 108.49 60.7 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.835 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -81.08 146.8 16.19 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.765 2.31 . . . . 0.0 113.205 -178.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.454 ' HA ' HD23 ' A' ' 10' ' ' LEU . 6.9 mt -133.82 10.72 3.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.565 177.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -86.87 174.27 8.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.961 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -86.53 147.33 43.82 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.878 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.18 115.53 2.54 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.932 2.422 . . . . 0.0 112.32 177.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.02 -166.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.85 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.44 51.92 12.11 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.896 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.4 -36.21 3.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.927 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.72 91.85 2.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.96 -54.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.837 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.14 13.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.945 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.9 125.57 24.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.806 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 21' ' ' ARG . 0.9 OUTLIER -112.62 12.83 19.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.982 -179.763 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.549 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 72.0 m95 -142.02 53.1 1.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.756 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.28 -156.64 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.794 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.484 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.25 -37.73 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.852 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.71 120.58 40.56 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.534 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.6 p -136.8 169.13 18.25 Favored 'General case' 0 C--N 1.331 -0.239 0 O-C-N 124.007 0.817 . . . . 0.0 110.869 -178.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.525 ' HG3' ' HG2' ' A' ' 28' ' ' GLU . 24.9 ptt? -96.15 -18.74 19.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.5 177.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.525 ' HG2' ' HG3' ' A' ' 27' ' ' MET . 33.1 mm-40 -108.86 101.73 10.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.694 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -104.21 125.0 50.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.667 178.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.434 ' HB2' ' HE3' ' A' ' 30' ' ' LYS . 34.1 ttmt -85.93 -76.19 0.35 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.973 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.5 p -141.64 -46.04 0.36 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.144 -179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' B' ' 457' ' ' ARG . 58.5 t -86.76 143.78 10.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.301 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.854 ' HB ' ' HD2' ' A' ' 34' ' ' PRO . 1.1 pp -126.8 169.19 12.51 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.288 -177.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.854 ' HD2' ' HB ' ' A' ' 33' ' ' ILE . 59.2 Cg_endo -71.13 159.75 51.24 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.833 2.355 . . . . 0.0 114.409 -173.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -148.35 -136.71 2.76 Favored Glycine 0 C--N 1.332 0.34 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.413 175.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.68 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 26.9 ttt -154.79 -58.56 0.02 OUTLIER Pre-proline 0 CA--C 1.536 0.435 0 CA-C-N 116.871 0.335 . . . . 0.0 111.593 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.68 ' HD3' ' HB3' ' A' ' 36' ' ' MET . 93.6 Cg_endo -81.81 124.06 4.38 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 121.776 1.65 . . . . 0.0 111.872 177.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.702 ' HB ' ' HA ' ' B' ' 460' ' ' VAL . 41.0 p -130.5 -22.17 2.76 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.65 -177.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.2 m -53.37 120.73 1.95 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-O 121.299 0.571 . . . . 0.0 111.999 -176.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.885 ' H ' ' HG2' ' B' ' 462' ' ' LYS . 58.8 mt -109.48 122.75 38.53 Favored Pre-proline 0 CA--C 1.532 0.261 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.495 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.477 ' O ' HD23 ' A' ' 44' ' ' LEU . 52.6 Cg_exo -55.23 157.57 13.85 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 123.767 2.978 . . . . 0.0 113.606 -177.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.487 ' HB3' ' HE1' ' B' ' 475' ' ' TRP . 46.5 Cg_endo -70.97 112.48 3.3 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.719 2.28 . . . . 0.0 113.477 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 124.02 54.53 0.19 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.574 175.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.482 ' HB3' ' HG3' ' A' ' 49' ' ' GLU . 3.6 mm? -126.89 150.02 49.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.93 0.395 . . . . 0.0 111.479 -175.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.423 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 7.6 p -90.76 155.93 18.44 Favored 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.35 173.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.525 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -63.01 -31.29 72.4 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-O 120.933 0.397 . . . . 0.0 111.388 -174.253 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.423 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.35 -45.06 61.53 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.29 -33.49 73.27 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.763 -177.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.482 ' HG3' ' HB3' ' A' ' 44' ' ' LEU . 43.6 mt-10 -61.04 -44.54 97.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.21 177.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.558 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.77 -43.38 98.94 Favored 'General case' 0 C--O 1.185 -2.318 0 CA-C-O 118.884 -0.579 . . . . 0.0 110.234 177.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.551 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.41 -43.41 88.62 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 123.739 0.65 . . . . 0.0 111.535 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -65.4 -39.07 91.74 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.858 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.684 ' HA ' HD23 ' A' ' 56' ' ' LEU . 36.0 mm -78.64 -41.09 24.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.365 -178.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.1 m -65.57 -35.5 75.39 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.84 0 CA-C-O 118.664 -0.684 . . . . 0.0 111.898 176.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.05 -43.04 91.65 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.509 0.595 . . . . 0.0 110.353 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.684 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.3 OUTLIER -64.93 -38.62 91.56 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.646 177.55 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.51 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 61.8 mt-30 -75.14 -30.37 60.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.421 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.47 HD13 HD13 ' A' ' 113' ' ' ILE . 72.5 mt -65.8 -47.02 87.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 122.836 0.454 . . . . 0.0 110.341 175.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.42 -41.16 85.3 Favored 'General case' 0 CA--C 1.512 -0.487 0 C-N-CA 120.335 -0.546 . . . . 0.0 110.64 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -70.33 -31.37 68.64 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.225 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.791 ' HG ' HG12 ' A' ' 33' ' ' ILE . 17.8 mt -67.64 -44.92 76.76 Favored 'General case' 0 C--O 1.207 -1.162 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 172.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.5 -35.81 82.0 Favored 'General case' 0 N--CA 1.432 -1.346 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -178.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.501 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.79 -42.76 76.05 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.537 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.79 -47.76 83.68 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 113.846 -1.524 . . . . 0.0 111.93 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.416 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.04 -29.0 63.73 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.867 176.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.96 -47.13 69.47 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.501 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.07 -17.69 14.41 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 119.974 -0.69 . . . . 0.0 112.815 -177.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.89 29.41 10.6 Favored Glycine 0 C--N 1.315 -0.621 0 C-N-CA 119.896 -1.145 . . . . 0.0 111.254 -177.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.4 92.95 7.11 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.214 0.531 . . . . 0.0 110.135 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.8 tp -103.39 -39.69 6.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.536 177.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 101.98 108.54 3.18 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.781 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.438 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 43.2 mm -105.81 113.2 64.13 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-O 120.802 0.334 . . . . 0.0 110.655 177.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 72' ' ' ILE . 8.3 Cg_exo -72.47 150.08 51.2 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.065 2.51 . . . . 0.0 112.4 179.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.73 144.7 97.82 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.906 2.404 . . . . 0.0 112.532 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 65.8 t30 65.34 99.73 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.458 0 O-C-N 123.722 0.639 . . . . 0.0 110.784 -176.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.64 173.73 13.86 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.85 2.366 . . . . 0.0 113.22 -176.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -95.3 156.95 16.1 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.048 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 62.33 -164.34 0.25 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.026 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.1 ttt180 -82.41 -53.45 5.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 0.0 110.048 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 m -126.28 115.46 23.53 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.29 159.64 46.27 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.875 2.383 . . . . 0.0 112.973 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.411 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 36.2 t -59.87 137.12 90.46 Favored Pre-proline 0 CA--C 1.532 0.261 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.476 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 82' ' ' SER . 50.3 Cg_exo -54.55 130.25 39.14 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.36 2.707 . . . . 0.0 112.981 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.585 ' HB3' ' HD3' ' A' ' 85' ' ' PRO . 22.3 tt0 -125.65 -54.8 0.03 OUTLIER Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.174 -176.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.585 ' HD3' ' HB3' ' A' ' 84' ' ' GLU . 3.6 Cg_exo -75.26 -28.38 8.8 Favored 'Trans proline' 0 C--N 1.362 1.26 0 C-N-CA 122.589 2.193 . . . . 0.0 113.363 -177.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.9 mm -77.89 126.32 38.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.85 0.357 . . . . 0.0 111.191 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -127.8 135.99 50.86 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.601 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -81.62 115.89 21.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.094 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 89.2 p -74.56 -30.41 61.72 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.375 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -83.02 -67.96 0.74 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.022 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 127.68 114.98 1.87 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.791 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.7 tttp -117.24 -32.55 4.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.106 0.479 . . . . 0.0 110.261 177.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -118.97 -169.45 1.73 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.36 178.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 mt -105.72 171.77 7.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.769 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -76.34 100.77 5.25 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.163 175.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -136.22 -50.13 0.68 Allowed 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 115.738 -0.664 . . . . 0.0 112.73 -175.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.09 -52.53 16.36 Favored 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.218 -0.926 . . . . 0.0 109.667 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.462 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.6 mp0 -53.34 -51.74 61.46 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-N 113.614 -1.63 . . . . 0.0 110.66 -178.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -66.61 -38.75 87.63 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 113.456 -1.702 . . . . 0.0 110.653 -177.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.533 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.87 -44.51 94.12 Favored 'General case' 0 CA--C 1.512 -0.495 0 O-C-N 123.265 0.353 . . . . 0.0 110.356 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.728 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.8 m -69.02 -50.05 52.26 Favored 'General case' 0 N--CA 1.428 -1.539 0 C-N-CA 120.069 -0.653 . . . . 0.0 110.637 179.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.45 -41.24 93.66 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -175.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.08 -39.1 89.78 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.19 -40.16 89.07 Favored 'General case' 0 C--O 1.223 -0.308 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.728 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.93 -41.09 97.73 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.648 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.0 -34.45 78.47 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.73 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.44 -34.29 74.21 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.55 -48.79 76.05 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 107.607 -1.256 . . . . 0.0 107.607 175.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.559 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.24 -45.54 94.11 Favored 'General case' 0 C--O 1.213 -0.819 0 CA-C-N 114.494 -1.23 . . . . 0.0 110.436 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.28 -37.42 85.46 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 123.565 0.746 . . . . 0.0 110.99 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.78 -43.74 85.78 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.7 mt -72.23 -38.63 68.92 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.769 177.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.559 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.39 -50.91 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 110.51 -0.181 . . . . 0.0 110.51 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.5 m -60.7 -39.46 88.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.195 0.521 . . . . 0.0 110.535 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.611 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.52 61.24 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.004 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.43 -37.09 84.41 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.8 t -65.54 -36.86 78.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 176.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.64 -40.72 80.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.226 0.536 . . . . 0.0 110.23 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.7 mt -71.61 -40.5 69.77 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.984 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.58 111.19 12.53 Favored Pre-proline 0 C--N 1.315 -0.896 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.013 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.68 -22.81 36.99 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.837 2.358 . . . . 0.0 112.558 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.16 0.01 55.98 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.191 -177.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.94 134.7 54.53 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.617 -178.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.39 109.07 62.8 Favored Pre-proline 0 CA--C 1.51 -0.589 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.32 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.23 157.93 59.67 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 122.261 1.974 . . . . 0.0 111.501 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.64 154.5 25.23 Favored 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 123.626 2.884 . . . . 0.0 111.768 177.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.08 -31.37 70.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -91.77 34.96 0.97 Allowed 'General case' 0 C--O 1.233 0.22 0 O-C-N 123.474 0.484 . . . . 0.0 111.618 -177.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -73.51 125.32 27.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.215 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -106.86 111.6 63.72 Favored Pre-proline 0 C--O 1.234 0.238 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.247 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -77.94 158.36 30.93 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.401 2.734 . . . . 0.0 112.201 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -64.2 161.46 33.89 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.75 2.3 . . . . 0.0 112.789 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . 61.06 -148.44 0.42 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.56 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.7 m 71.14 95.74 0.07 Allowed 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.964 178.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -109.4 -41.97 4.47 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.38 175.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 22.5 m -101.08 162.11 3.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.406 -178.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 74.4 m -126.2 130.39 50.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.455 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -78.26 98.4 5.89 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.112 0.482 . . . . 0.0 110.682 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 57.5 tttm -102.1 124.61 47.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.173 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 16.1 m -83.99 144.32 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.585 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.13 133.74 23.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.027 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 18.6 pt -85.5 153.68 58.84 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.233 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -57.18 133.04 54.97 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.926 2.417 . . . . 0.0 112.697 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -80.81 127.43 32.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.019 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.068 -0.968 . . . . 0.0 111.01 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.255 0 N-CA-C 112.669 -0.172 . . . . 0.0 112.669 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 373' ' ' HIS . . . . . 0.455 ' HA ' ' HD3' ' B' ' 374' ' ' PRO . 95.9 m-70 -86.48 134.12 38.72 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.596 0.198 . . . . 0.0 110.905 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 374' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' B' ' 373' ' ' HIS . 31.8 Cg_exo -59.5 147.6 90.77 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.985 2.457 . . . . 0.0 112.529 178.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 375' ' ' THR . . . . . 0.468 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -143.35 -71.42 0.31 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.179 -177.557 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 376' ' ' GLU . . . . . 0.485 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.9 -45.91 0.01 OUTLIER 'General case' 0 C--O 1.231 0.108 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 377' ' ' VAL . . . . . 0.558 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.95 7.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.478 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 378' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' B' ' 433' ' ' PHE . 0.2 OUTLIER -90.63 152.5 20.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.193 -178.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 379' ' ' CYS . . . . . 0.604 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.53 142.53 46.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.631 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.61 HD23 HG22 ' B' ' 461' ' ' THR . 5.3 mt -132.71 102.33 5.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.891 0.377 . . . . 0.0 111.01 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 21.6 ttt -117.15 164.89 14.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.26 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.2 t30 58.15 51.12 8.97 Favored 'General case' 0 C--O 1.232 0.154 0 O-C-N 123.338 0.399 . . . . 0.0 111.278 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 383' ' ' MET . . . . . 0.79 ' HB3' HG12 ' B' ' 459' ' ' VAL . 3.0 ptm -164.86 14.37 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.258 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 384' ' ' VAL . . . . . 0.733 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.27 125.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 0.0 111.372 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.83 151.7 43.08 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.4 179.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.07 -23.52 73.62 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.353 2.035 . . . . 0.0 112.36 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.89 -5.48 53.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.494 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.77 5.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.872 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 389' ' ' LEU . . . . . 0.473 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.97 0.46 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.969 0.414 . . . . 0.0 110.615 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.58 -15.72 5.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.652 179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.36 148.76 23.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.542 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -73.57 -30.16 62.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.276 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.42 -47.66 26.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.713 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.6 -44.25 91.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.743 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.44 -59.32 5.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.221 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -27.38 61.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.27 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.08 -41.06 67.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.423 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 398' ' ' ILE . . . . . 0.493 HD13 HG12 ' B' ' 384' ' ' VAL . 65.5 mt -74.94 -53.64 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.516 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 399' ' ' VAL . . . . . 0.615 HG22 HD12 ' B' ' 417' ' ' ILE . 59.4 t -53.25 -46.98 57.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.807 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.42 -60.0 3.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.789 0.328 . . . . 0.0 111.523 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.52 -57.31 11.15 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.359 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.01 -32.96 15.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.326 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 403' ' ' ARG . . . . . 0.46 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.2 OUTLIER -71.18 -57.38 4.56 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.715 0.293 . . . . 0.0 111.149 -179.919 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.93 -33.69 64.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.15 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 405' ' ' GLU . . . . . 0.549 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.43 -47.02 45.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.96 -23.87 67.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.171 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.39 1.1 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.966 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.1 -17.17 12.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.877 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.61 -15.47 14.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.561 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.12 -139.41 4.15 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.536 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.29 132.46 56.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.714 0.292 . . . . 0.0 111.065 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 412' ' ' VAL . . . . . 0.433 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.39 115.46 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.991 0.424 . . . . 0.0 110.58 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.64 -61.93 2.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.226 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.04 -169.4 3.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.109 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 415' ' ' ILE . . . . . 0.617 HG23 HG12 ' B' ' 434' ' ' VAL . 48.8 mt -145.09 128.83 11.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 416' ' ' GLU . . . . . 0.436 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.78 108.83 18.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.732 179.781 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 417' ' ' ILE . . . . . 1.008 HG23 HG21 ' B' ' 432' ' ' ILE . 60.5 mt -128.53 108.47 19.04 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.708 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 418' ' ' PRO . . . . . 0.632 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.5 147.6 9.01 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.663 2.242 . . . . 0.0 112.904 -179.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.84 74.75 22.06 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.143 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.27 117.11 2.07 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.79 2.327 . . . . 0.0 112.402 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 421' ' ' VAL . . . . . 0.581 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.5 t -74.39 97.78 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.187 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.57 21.82 9.06 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.557 0.694 . . . . 0.0 109.314 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 423' ' ' GLY . . . . . 0.648 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.39 29.22 6.07 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 114.766 -1.106 . . . . 0.0 111.278 -179.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 424' ' ' VAL . . . . . 0.581 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.5 -37.6 30.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.103 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.84 35.97 4.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.804 0.335 . . . . 0.0 111.753 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 426' ' ' VAL . . . . . 0.667 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.39 -44.63 47.0 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.819 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 427' ' ' PRO . . . . . 0.667 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.33 77.07 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.473 2.115 . . . . 0.0 111.107 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.31 -15.38 3.21 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.313 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.2 t -67.52 149.39 50.23 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.511 0.196 . . . . 0.0 110.885 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.5 -14.27 5.06 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.912 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.37 126.17 44.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.845 0.355 . . . . 0.0 111.08 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 432' ' ' ILE . . . . . 1.008 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.08 172.93 15.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.281 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 433' ' ' PHE . . . . . 0.604 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.37 2.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.958 0.409 . . . . 0.0 111.962 -178.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 434' ' ' VAL . . . . . 0.617 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.82 141.72 41.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.176 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 435' ' ' GLU . . . . . 0.486 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.4 108.55 17.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.821 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.78 168.37 12.52 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.249 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 437' ' ' THR . . . . . 0.698 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -94.96 -45.43 7.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.404 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.85 146.69 52.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.128 0.489 . . . . 0.0 111.183 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.22 -12.84 16.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.192 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.8 26.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.123 0.487 . . . . 0.0 110.129 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.15 -29.44 60.48 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.889 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.14 -31.81 72.34 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.186 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.69 -48.03 15.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.646 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.07 59.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.709 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.83 -54.9 3.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.961 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 446' ' ' MET . . . . . 0.474 ' HB3' HD21 ' B' ' 378' ' ' LEU . 4.1 ptm -64.76 -27.57 68.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.957 -179.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.58 -16.2 63.36 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.64 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.66 -8.53 22.57 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.464 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 449' ' ' LEU . . . . . 0.408 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.3 mt -95.82 -19.77 19.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.712 0.291 . . . . 0.0 110.916 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 450' ' ' THR . . . . . 0.448 HG22 ' OG1' ' A' ' 38' ' ' THR . 23.1 p -69.54 131.36 44.57 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.104 175.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.63 -9.59 76.66 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.677 -0.773 . . . . 0.0 113.377 176.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 452' ' ' ARG . . . . . 0.427 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -75.74 -152.2 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 117.2 0.5 . . . . 0.0 110.513 178.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 453' ' ' LYS . . . . . 0.486 ' HZ1' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -160.87 117.15 2.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.948 0.404 . . . . 0.0 111.338 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.23 -36.4 75.37 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.542 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.21 -50.98 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.846 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.25 25.0 0.3 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.787 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 457' ' ' ARG . . . . . 0.623 ' HB3' ' HB ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -149.47 136.22 19.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.325 179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 458' ' ' VAL . . . . . 0.458 HG12 HE21 ' A' ' 57' ' ' GLN . 7.2 p -58.38 132.23 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 121.124 0.488 . . . . 0.0 110.949 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 459' ' ' VAL . . . . . 0.79 HG12 ' HB3' ' B' ' 383' ' ' MET . 0.9 OUTLIER -90.99 122.12 42.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.819 -174.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 460' ' ' VAL . . . . . 0.702 ' HA ' ' HB ' ' A' ' 38' ' ' THR . 59.6 t -88.89 98.21 7.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.319 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 461' ' ' THR . . . . . 0.61 HG22 HD23 ' B' ' 380' ' ' LEU . 1.4 p -98.12 129.64 44.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.842 177.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 462' ' ' LYS . . . . . 0.885 ' HG2' ' H ' ' A' ' 40' ' ' ILE . 0.5 OUTLIER -130.58 -166.35 1.67 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.268 0.556 . . . . 0.0 111.148 -179.045 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.59 146.93 37.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.525 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 464' ' ' CYS . . . . . 0.626 ' SG ' ' HB3' ' B' ' 475' ' ' TRP . 0.5 OUTLIER -136.81 148.98 47.48 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.065 0.46 . . . . 0.0 111.378 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 465' ' ' ASP . . . . . 0.468 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.46 129.35 66.42 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.398 -179.881 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 466' ' ' PRO . . . . . 0.485 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.06 -33.21 72.62 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.685 2.257 . . . . 0.0 112.103 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.07 -58.48 7.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.38 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.5 -33.67 68.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.25 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 469' ' ' TYR . . . . . 0.486 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.1 -51.18 70.7 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.183 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.37 -47.53 69.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.37 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 471' ' ' ARG . . . . . 0.451 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.73 -2.09 49.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.45 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.09 20.8 8.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.975 0.417 . . . . 0.0 110.275 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 473' ' ' ASP . . . . . 0.451 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.85 -21.48 29.49 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.954 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 70.05 157.29 0.16 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.121 0.568 . . . . 0.0 111.264 -177.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 475' ' ' TRP . . . . . 0.626 ' HB3' ' SG ' ' B' ' 464' ' ' CYS . 44.0 t-105 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.359 -0.829 . . . . 0.0 111.226 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.1 mtp . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 120.446 0.165 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 61.41 -101.42 0.11 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.771 0.669 . . . . 0.0 111.84 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 t -147.42 -9.64 0.43 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.197 0.523 . . . . 0.0 110.422 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.73 -4.89 0.11 Allowed Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.208 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 60.46 -160.13 0.3 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.945 0.498 . . . . 0.0 111.73 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -85.8 148.22 25.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.421 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.91 143.82 32.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.05 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.412 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.0 t -72.34 128.52 88.69 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.795 178.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 31.2 Cg_exo -59.88 137.8 78.64 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.944 2.429 . . . . 0.0 112.652 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' A' ' 10' ' ' LEU . 11.9 tp -98.44 16.14 22.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.056 177.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -75.19 -43.71 50.58 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.785 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 31.3 p90 -78.55 146.22 69.13 Favored Pre-proline 0 C--O 1.233 0.189 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.279 176.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 38.8 Cg_exo -56.52 115.56 2.57 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 123.265 2.643 . . . . 0.0 112.323 -174.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.04 -166.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.92 12.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.94 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.36 -36.27 3.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.995 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.8 2.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.856 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.84 -54.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.812 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.9 111.13 13.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.94 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.92 125.59 24.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.697 179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.62 12.88 19.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.992 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.553 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.8 m95 -142.06 53.02 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.706 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.29 -156.54 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.84 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.471 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.33 -37.63 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.867 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.75 121.29 42.86 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 119.004 -0.522 . . . . 0.0 110.557 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 p -121.99 -64.63 1.19 Allowed 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.625 0.578 . . . . 0.0 111.067 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mpt? 59.67 29.23 18.78 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.636 0.585 . . . . 0.0 111.421 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -103.45 -57.7 2.0 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.22 178.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -156.95 172.17 19.14 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.259 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 44.2 mtpt 63.53 -157.43 0.32 Allowed 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.468 0.48 . . . . 0.0 111.715 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 40.0 p -92.94 130.6 38.47 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.868 0.366 . . . . 0.0 111.559 -177.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.1 p -127.53 135.42 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.371 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.666 ' H ' ' HZ1' ' B' ' 453' ' ' LYS . 0.0 OUTLIER -143.84 136.42 13.5 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.418 177.593 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.619 ' HD2' HG12 ' A' ' 33' ' ' ILE . 76.1 Cg_exo -52.27 160.2 3.6 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 123.227 2.618 . . . . 0.0 113.367 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -73.52 89.49 0.63 Allowed Glycine 0 N--CA 1.451 -0.346 0 CA-C-N 115.776 -0.647 . . . . 0.0 113.125 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.436 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 24.0 mmt -115.33 133.61 22.7 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-O 120.641 0.258 . . . . 0.0 111.132 178.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 36' ' ' MET . 24.6 Cg_exo -63.78 134.91 45.9 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.903 2.402 . . . . 0.0 111.955 176.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.6 t -153.93 23.82 0.5 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.957 0.408 . . . . 0.0 110.949 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.645 ' HA ' HG12 ' B' ' 460' ' ' VAL . 2.7 m -52.84 119.76 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.257 -176.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.858 HG13 HG11 ' B' ' 460' ' ' VAL . 84.2 mt -64.85 132.78 95.55 Favored Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.135 177.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.507 ' HA ' ' HD3' ' A' ' 42' ' ' PRO . 26.1 Cg_exo -64.56 147.38 90.24 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 122.67 2.247 . . . . 0.0 112.198 175.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 9.8 Cg_exo -72.31 104.59 1.71 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.916 2.41 . . . . 0.0 113.019 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 136.1 46.51 0.09 OUTLIER Glycine 0 C--N 1.333 0.382 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.46 176.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 44' ' ' LEU . 3.4 mm? -121.63 156.84 32.11 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.927 0.394 . . . . 0.0 111.521 -176.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.459 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 1.4 p -84.93 154.27 22.31 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.605 175.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.522 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.06 -31.3 71.71 Favored 'General case' 0 C--O 1.24 0.597 0 O-C-N 123.368 0.418 . . . . 0.0 111.395 -175.029 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.459 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.3 -45.23 60.91 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.18 -32.69 72.17 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.586 -0.733 . . . . 0.0 110.753 -177.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.454 ' O ' HG12 ' A' ' 53' ' ' ILE . 36.1 mt-10 -61.16 -44.78 96.78 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.243 178.01 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.561 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.37 -43.32 97.94 Favored 'General case' 0 C--O 1.186 -2.252 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.235 177.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.552 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.43 -42.13 86.61 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 123.719 0.637 . . . . 0.0 111.585 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -66.29 -38.86 88.76 Favored 'General case' 0 N--CA 1.462 0.165 0 O-C-N 123.824 0.703 . . . . 0.0 110.933 178.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.598 ' HA ' HD23 ' A' ' 56' ' ' LEU . 29.6 mm -78.31 -41.52 26.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.197 -179.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.561 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -66.41 -35.44 74.92 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.809 0 CA-C-O 118.586 -0.721 . . . . 0.0 111.958 177.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.15 -45.43 90.99 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 118.541 0.61 . . . . 0.0 110.308 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.598 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.1 OUTLIER -70.55 -23.71 62.67 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.077 -178.321 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -89.53 -26.67 20.75 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.669 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.487 HD13 HD13 ' A' ' 113' ' ' ILE . 72.7 mt -64.04 -46.94 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.175 0.59 . . . . 0.0 110.395 170.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.433 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.45 -41.15 85.17 Favored 'General case' 0 CA--C 1.513 -0.474 0 C-N-CA 120.294 -0.563 . . . . 0.0 110.685 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -36.5 83.11 Favored 'General case' 0 C--N 1.341 0.211 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.844 178.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.529 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -66.61 -44.95 80.71 Favored 'General case' 0 C--O 1.206 -1.187 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.9 m -65.51 -35.81 81.98 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.82 -42.76 76.19 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 122.095 0.95 . . . . 0.0 108.53 176.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.529 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.76 -47.73 83.88 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 113.827 -1.533 . . . . 0.0 111.897 179.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.423 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.23 -28.79 63.39 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 119.741 -0.784 . . . . 0.0 111.831 176.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -68.1 -47.07 69.19 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.48 14.46 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 119.965 -0.694 . . . . 0.0 112.86 -177.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.77 29.41 10.74 Favored Glycine 0 C--N 1.316 -0.565 0 C-N-CA 119.804 -1.188 . . . . 0.0 111.28 -177.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.4 91.08 6.77 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.253 0.549 . . . . 0.0 110.215 -179.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -122.68 -32.43 3.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.454 178.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 138.2 -168.12 24.71 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.354 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.481 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 44.6 mm -94.79 113.11 60.41 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.796 0.331 . . . . 0.0 110.687 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 72' ' ' ILE . 5.8 Cg_exo -79.54 152.61 23.13 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 123.087 2.525 . . . . 0.0 112.253 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.6 -28.55 52.78 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.713 2.275 . . . . 0.0 112.279 177.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -100.21 124.79 41.92 Favored Pre-proline 0 CA--C 1.53 0.191 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.708 178.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.22 143.42 53.4 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.883 2.389 . . . . 0.0 112.33 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -110.32 -31.42 7.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.36 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -124.17 31.09 5.89 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.466 -0.333 . . . . 0.0 111.864 -176.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 85.1 mtt180 -124.02 -27.28 3.91 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.658 0.266 . . . . 0.0 111.57 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.8 p -88.88 153.81 49.73 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.935 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.52 130.89 35.42 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.05 2.5 . . . . 0.0 112.486 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 29.3 t -138.64 93.64 10.84 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.127 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -90.28 121.83 0.92 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.264 2.642 . . . . 0.0 112.686 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -148.43 106.72 3.55 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.948 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo -72.97 151.63 50.62 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.918 2.412 . . . . 0.0 112.066 177.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 4.8 pt -89.92 109.82 21.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.102 0.477 . . . . 0.0 111.575 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -128.21 -41.75 1.56 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.241 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -103.83 134.23 47.49 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.55 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 57.9 m -71.0 -47.52 58.31 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.295 -177.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -103.73 88.58 3.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.026 0.441 . . . . 0.0 110.498 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -91.34 165.67 30.22 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.659 -177.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 89.6 mttt 60.27 85.2 0.11 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.158 0.504 . . . . 0.0 111.699 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -112.71 5.06 17.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.864 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -103.58 -78.37 0.55 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.959 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 66.79 104.2 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 123.316 0.647 . . . . 0.0 112.374 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -111.86 -50.19 2.93 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.774 174.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.11 -52.5 16.46 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.261 -0.9 . . . . 0.0 109.706 -178.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.458 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.3 mp0 -53.34 -51.7 61.58 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-N 113.663 -1.608 . . . . 0.0 110.656 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.64 -38.75 87.55 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.435 -1.712 . . . . 0.0 110.704 -177.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.53 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.83 -44.59 93.98 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 123.237 0.336 . . . . 0.0 110.371 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.722 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.7 m -69.05 -50.0 52.49 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.613 179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.46 -41.27 93.55 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -175.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.0 -39.17 90.05 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 110.351 -0.241 . . . . 0.0 110.351 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 100' ' ' ARG . 6.2 tmtt? -60.23 -40.13 89.12 Favored 'General case' 0 C--O 1.223 -0.308 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.5 mt -63.93 -41.06 97.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.135 -0.938 . . . . 0.0 110.663 178.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.01 -34.36 78.26 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.811 178.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.52 -34.29 74.05 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 177.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.45 -48.86 75.99 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 175.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.559 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.2 ttp180 -61.26 -45.51 94.21 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.441 179.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.21 -37.47 85.47 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 123.567 0.747 . . . . 0.0 111.016 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.79 -43.73 85.8 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.8 mt -72.3 -38.49 68.73 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.814 177.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.559 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.4 -50.98 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 110.472 -0.195 . . . . 0.0 110.472 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.9 m -60.6 -39.6 88.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.219 0.533 . . . . 0.0 110.514 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.608 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.89 -49.64 60.83 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.952 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.1 84.46 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.3 t -65.52 -36.87 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 176.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.7 79.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.197 0.523 . . . . 0.0 110.22 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.3 mt -71.46 -40.56 70.23 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.045 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.63 111.22 12.48 Favored Pre-proline 0 C--N 1.316 -0.853 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.76 -22.63 36.8 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.861 2.374 . . . . 0.0 112.588 -178.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.34 0.07 55.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.405 0.621 . . . . 0.0 111.178 -177.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.84 134.61 54.43 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.61 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.35 109.16 62.89 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.323 177.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.27 157.92 59.76 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.271 1.981 . . . . 0.0 111.501 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.56 154.5 24.82 Favored 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 123.648 2.899 . . . . 0.0 111.813 177.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.1 -31.49 71.13 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -90.08 20.73 4.1 Favored 'General case' 0 C--O 1.232 0.178 0 O-C-N 123.771 0.669 . . . . 0.0 111.733 -176.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -74.15 119.86 18.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.815 0.34 . . . . 0.0 110.151 175.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 131' ' ' PRO . 53.2 tttt -108.74 120.0 47.46 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.919 -178.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 130' ' ' LYS . 18.7 Cg_exo -66.34 135.51 40.04 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 123.049 2.5 . . . . 0.0 112.424 179.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 24.7 Cg_exo -64.24 -43.8 13.71 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.181 2.587 . . . . 0.0 112.81 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -127.7 125.84 40.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.977 0.417 . . . . 0.0 111.278 -179.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 27.9 p -111.44 125.73 54.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.906 178.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -88.14 161.0 17.53 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.239 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 17.5 m -89.02 -20.65 7.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.419 -179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 71.3 m -116.99 98.52 6.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.792 0.33 . . . . 0.0 110.896 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -100.01 110.07 22.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.597 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 12.2 pttm -79.47 -22.02 44.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.626 -178.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 2.7 m -81.55 121.81 35.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.105 0.479 . . . . 0.0 111.152 178.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 21.8 mmt -110.67 155.84 21.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 -178.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.766 HD13 ' H ' ' A' ' 142' ' ' ILE . 0.2 OUTLIER -95.04 147.65 33.39 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.556 177.041 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 142' ' ' ILE . 24.6 Cg_exo -63.59 131.54 31.97 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.678 2.252 . . . . 0.0 112.11 179.01 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -104.79 162.36 13.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.029 -179.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.432 -0.794 . . . . 0.0 110.964 -179.634 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.145 0 N-CA-C 112.599 -0.2 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -94.63 132.7 28.11 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 120.679 0.276 . . . . 0.0 111.148 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -69.05 142.68 51.78 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.943 2.429 . . . . 0.0 112.973 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 375' ' ' THR . . . . . 0.454 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -120.84 -71.3 0.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.166 178.638 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 376' ' ' GLU . . . . . 0.492 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.96 0.01 OUTLIER 'General case' 0 C--O 1.231 0.097 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 377' ' ' VAL . . . . . 0.554 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.95 7.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.471 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 378' ' ' LEU . . . . . 0.49 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.55 152.54 20.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.271 -179.072 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 379' ' ' CYS . . . . . 0.611 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.57 142.53 46.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.59 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.51 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.73 101.82 5.43 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.925 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 381' ' ' MET . . . . . 0.403 ' HG2' ' N ' ' B' ' 382' ' ' ASN . 20.3 ttt -116.83 164.7 14.27 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.59 -178.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 382' ' ' ASN . . . . . 0.403 ' N ' ' HG2' ' B' ' 381' ' ' MET . 13.1 t30 58.58 51.19 8.14 Favored 'General case' 0 C--N 1.342 0.278 0 O-C-N 123.479 0.487 . . . . 0.0 111.316 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 383' ' ' MET . . . . . 0.433 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.85 14.4 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.253 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 384' ' ' VAL . . . . . 0.737 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.31 125.17 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.845 0.355 . . . . 0.0 111.311 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.412 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.0 mt -110.78 151.78 43.1 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.34 179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.25 -23.35 72.5 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.273 1.982 . . . . 0.0 112.343 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.94 -5.52 53.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.484 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.02 -36.76 5.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.904 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 389' ' ' LEU . . . . . 0.477 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.96 34.92 0.46 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.913 0.387 . . . . 0.0 110.636 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.55 -15.66 5.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.659 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.31 148.71 23.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.573 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -73.5 -30.25 63.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.225 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.35 -47.68 26.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.754 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.51 -44.26 91.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.852 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.41 -59.45 4.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.162 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -27.29 61.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.275 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.23 -40.94 67.39 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.429 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 398' ' ' ILE . . . . . 0.496 HD13 HG12 ' B' ' 384' ' ' VAL . 65.5 mt -74.93 -53.65 16.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.525 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 399' ' ' VAL . . . . . 0.617 HG22 HD12 ' B' ' 417' ' ' ILE . 59.7 t -53.3 -46.86 57.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.846 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.47 -60.0 3.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.74 0.305 . . . . 0.0 111.526 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.69 -57.14 11.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.341 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.7 t -52.04 -32.99 15.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.387 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 403' ' ' ARG . . . . . 0.46 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.15 -57.39 4.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.802 0.334 . . . . 0.0 111.173 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.9 -33.62 64.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.214 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 405' ' ' GLU . . . . . 0.553 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 22.0 mm-40 -73.48 -47.06 44.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.963 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.81 -23.97 67.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.131 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.08 30.25 1.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.895 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.01 -17.18 12.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.897 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.42 14.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.551 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.14 -139.46 4.17 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.553 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.21 132.51 56.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.696 0.284 . . . . 0.0 111.09 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 412' ' ' VAL . . . . . 0.422 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.38 115.45 48.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.028 0.442 . . . . 0.0 110.658 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.69 -61.97 2.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.179 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.96 -169.33 3.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.188 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 415' ' ' ILE . . . . . 0.613 HG23 HG12 ' B' ' 434' ' ' VAL . 48.6 mt -145.2 128.94 11.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.825 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 416' ' ' GLU . . . . . 0.429 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.93 108.76 18.64 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.692 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 417' ' ' ILE . . . . . 0.969 HG23 HG21 ' B' ' 432' ' ' ILE . 60.1 mt -128.42 108.48 19.24 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.688 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 418' ' ' PRO . . . . . 0.637 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.48 147.61 8.95 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.673 2.248 . . . . 0.0 112.913 -179.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.86 74.61 22.1 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.155 179.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.1 117.0 1.96 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.782 2.321 . . . . 0.0 112.46 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 421' ' ' VAL . . . . . 0.599 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.2 t -74.34 97.84 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.199 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.5 21.84 8.99 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.61 0.719 . . . . 0.0 109.386 -179.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 423' ' ' GLY . . . . . 0.634 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.31 29.21 6.1 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.273 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 424' ' ' VAL . . . . . 0.599 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.42 -37.57 31.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 111.872 0.323 . . . . 0.0 111.872 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.86 35.92 4.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.331 . . . . 0.0 111.825 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 426' ' ' VAL . . . . . 0.677 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.41 -44.59 46.65 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.827 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 427' ' ' PRO . . . . . 0.677 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.8 Cg_endo -66.3 77.07 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.516 2.144 . . . . 0.0 111.113 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.34 -15.47 3.2 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.338 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.53 149.37 50.25 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.591 0.234 . . . . 0.0 110.793 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.54 -14.24 5.05 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.856 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 126.16 44.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.833 0.349 . . . . 0.0 111.028 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 432' ' ' ILE . . . . . 0.969 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -131.03 172.89 15.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.243 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 433' ' ' PHE . . . . . 0.611 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.3 2.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.989 0.423 . . . . 0.0 111.974 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 434' ' ' VAL . . . . . 0.613 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.88 141.71 41.11 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 115.668 -0.697 . . . . 0.0 111.207 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 435' ' ' GLU . . . . . 0.484 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.3 108.49 17.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.819 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.79 168.36 12.53 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.227 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 437' ' ' THR . . . . . 0.698 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.93 -45.39 7.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.438 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.91 146.66 52.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.096 0.474 . . . . 0.0 111.215 -179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.25 -12.7 16.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.263 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.61 -54.87 25.12 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.082 0.468 . . . . 0.0 110.088 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.16 -29.37 60.43 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.864 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.32 -31.68 72.32 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.168 179.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 443' ' ' GLN . . . . . 0.4 HE21 ' HB3' ' B' ' 443' ' ' GLN . 6.2 tt0 -78.64 -48.06 15.83 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.649 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.59 -12.08 59.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.719 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -55.6 3.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.993 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 446' ' ' MET . . . . . 0.49 ' HB3' HD21 ' B' ' 378' ' ' LEU . 3.4 ptm -64.14 -26.98 68.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.178 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.16 -16.25 63.06 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.625 178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.51 22.7 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.415 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 449' ' ' LEU . . . . . 0.66 ' HB2' HG21 ' B' ' 461' ' ' THR . 97.2 mt -95.72 -20.55 18.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.797 0.332 . . . . 0.0 110.894 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 3.3 t -72.59 131.72 42.83 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.899 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.98 -9.81 72.53 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.606 -0.807 . . . . 0.0 113.157 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 452' ' ' ARG . . . . . 0.417 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.3 mmm180 -77.11 -152.22 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 117.239 0.52 . . . . 0.0 110.587 178.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 453' ' ' LYS . . . . . 0.666 ' HZ1' ' H ' ' A' ' 33' ' ' ILE . 0.0 OUTLIER -160.83 117.08 2.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.853 0.358 . . . . 0.0 111.285 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.23 -36.43 75.44 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.524 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.16 -50.92 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.814 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.23 24.86 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.761 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 457' ' ' ARG . . . . . 0.433 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.38 134.77 18.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.344 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 2.8 m -59.65 138.42 20.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-O 121.042 0.449 . . . . 0.0 111.62 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 57.5 t -98.73 115.79 40.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.419 -176.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 460' ' ' VAL . . . . . 0.858 HG11 HG13 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -82.81 114.5 23.75 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.796 174.385 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 461' ' ' THR . . . . . 0.66 HG21 ' HB2' ' B' ' 449' ' ' LEU . 14.1 p -100.96 132.14 46.51 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.139 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 462' ' ' LYS . . . . . 0.416 ' HD2' ' HB ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -127.46 -175.74 3.54 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.727 0.775 . . . . 0.0 111.455 -177.045 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -111.54 146.9 36.5 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.473 172.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 464' ' ' CYS . . . . . 0.554 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 149.03 47.47 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.992 0.425 . . . . 0.0 111.431 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 465' ' ' ASP . . . . . 0.454 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.46 129.36 66.37 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.374 -179.812 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 466' ' ' PRO . . . . . 0.492 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -53.98 -33.31 72.16 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.76 2.307 . . . . 0.0 112.127 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -58.49 7.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.399 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.44 -33.72 68.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.278 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 469' ' ' TYR . . . . . 0.484 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.03 -51.23 70.54 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.203 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.36 -47.6 69.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.291 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 471' ' ' ARG . . . . . 0.453 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.67 -2.19 49.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.383 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.78 8.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.951 0.405 . . . . 0.0 110.234 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 473' ' ' ASP . . . . . 0.453 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.66 -20.45 21.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.951 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 11.5 p90 56.29 19.29 3.85 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.82 1.248 . . . . 0.0 112.771 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.828 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.8 tpp . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.808 0.337 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -119.24 97.65 5.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.931 178.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.0 t -91.78 131.25 37.28 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.042 0.449 . . . . 0.0 111.248 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -136.96 -44.39 0.09 OUTLIER Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.599 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -87.16 -16.02 36.64 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.503 0.192 . . . . 0.0 111.106 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 65.02 -172.57 0.18 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.686 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -104.68 -21.35 13.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.593 178.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.404 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.2 t -127.15 132.33 24.27 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.082 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 20.0 Cg_exo -66.61 142.9 66.31 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.857 2.371 . . . . 0.0 112.09 176.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.8 mp -74.61 109.93 8.49 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.878 0.37 . . . . 0.0 111.107 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -152.06 119.6 6.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.633 -179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -95.33 151.49 38.71 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.948 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.28 115.57 2.57 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.936 2.424 . . . . 0.0 112.25 172.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.02 -166.75 1.32 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.859 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.41 51.91 12.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.878 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.3 -36.29 3.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.043 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.76 91.89 2.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.855 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.9 -54.33 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.786 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.82 111.24 13.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.01 125.63 25.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.787 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.59 12.78 19.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.976 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.552 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.4 m95 -141.97 53.08 1.48 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.791 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -156.58 0.13 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.854 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.475 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.33 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.927 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.73 120.36 39.81 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 118.958 -0.544 . . . . 0.0 110.609 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 1.025 ' HB ' HG21 ' A' ' 32' ' ' VAL . 2.9 m -145.78 147.4 31.83 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 123.655 0.597 . . . . 0.0 110.782 -177.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.61 ' HG3' ' HG3' ' A' ' 28' ' ' GLU . 9.7 tpt -123.94 130.64 52.91 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.495 -177.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.61 ' HG3' ' HG3' ' A' ' 27' ' ' MET . 48.3 mt-10 75.3 -32.09 0.21 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 174.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -81.59 96.34 7.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.728 0.299 . . . . 0.0 111.262 -177.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? 64.21 -176.04 0.16 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.846 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 37.9 p -89.52 106.09 18.23 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.073 0.463 . . . . 0.0 111.035 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 1.025 HG21 ' HB ' ' A' ' 26' ' ' THR . 48.6 t -106.01 103.28 15.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.73 -174.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.825 ' HB ' ' HZ2' ' A' ' 64' ' ' LYS . 2.2 tp -111.33 104.63 56.36 Favored Pre-proline 0 CA--C 1.54 0.561 0 CA-C-O 121.014 0.435 . . . . 0.0 111.618 176.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -67.17 144.3 68.4 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.966 2.444 . . . . 0.0 112.056 176.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -134.88 -143.98 4.91 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.3 -0.952 . . . . 0.0 113.605 -177.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.79 ' HB3' ' HD2' ' A' ' 37' ' ' PRO . 64.9 mtt -130.9 -177.93 0.75 Allowed Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 122.788 0.435 . . . . 0.0 110.18 -175.297 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.79 ' HD2' ' HB3' ' A' ' 36' ' ' MET . 1.2 Cg_endo -45.22 146.5 2.85 Favored 'Trans proline' 0 C--N 1.365 1.403 0 C-N-CA 122.911 2.408 . . . . 0.0 112.399 172.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.544 ' CB ' ' HA ' ' B' ' 460' ' ' VAL . 16.6 p -131.46 45.41 2.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.674 -169.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.9 m -95.15 112.04 26.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.661 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.823 ' H ' ' HG2' ' B' ' 462' ' ' LYS . 0.4 OUTLIER -80.12 136.79 53.42 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-O 120.883 0.373 . . . . 0.0 110.915 -175.611 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 40' ' ' ILE . 8.0 Cg_exo -73.99 127.67 11.63 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.165 2.576 . . . . 0.0 112.321 178.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 31.6 Cg_exo -60.48 154.33 54.49 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.119 2.546 . . . . 0.0 112.812 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 85.57 50.16 4.1 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.944 -0.646 . . . . 0.0 111.491 -175.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.497 ' CD2' ' HB2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -143.62 163.53 32.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.942 0.401 . . . . 0.0 111.665 -173.454 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.52 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 23.3 p -106.08 163.43 12.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.178 178.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.512 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -60.98 -31.39 70.98 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.337 -176.504 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.52 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.32 -45.17 61.13 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.11 -33.44 73.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.762 -177.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.497 ' HB2' ' CD2' ' A' ' 44' ' ' LEU . 41.6 tt0 -58.89 -46.49 87.73 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.344 177.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.553 ' O ' HG22 ' A' ' 54' ' ' VAL . 16.0 mmt180 -63.21 -43.36 98.34 Favored 'General case' 0 C--O 1.185 -2.304 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.267 177.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.539 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.45 -42.15 86.74 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 123.739 0.649 . . . . 0.0 111.58 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -64.31 -44.98 89.91 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.162 176.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.452 HD13 ' HA ' ' A' ' 53' ' ' ILE . 8.6 mm -71.5 -41.73 72.6 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.319 -179.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.553 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.0 m -67.21 -35.64 74.66 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.768 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.835 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.01 -43.32 91.52 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 118.558 0.617 . . . . 0.0 110.277 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.609 ' HG ' ' N ' ' A' ' 57' ' ' GLN . 0.1 OUTLIER -63.23 -41.91 99.16 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.776 176.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.609 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 52.0 mt-30 -72.51 -31.27 65.2 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.742 178.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.474 HD13 HD13 ' A' ' 113' ' ' ILE . 73.3 mt -64.51 -47.0 91.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 123.147 0.279 . . . . 0.0 110.447 176.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.46 -41.39 84.76 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.231 -0.588 . . . . 0.0 110.701 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.567 ' HB3' HD11 ' A' ' 33' ' ' ILE . 69.3 m-20 -69.1 -33.61 73.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.176 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.541 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -65.92 -45.0 83.52 Favored 'General case' 0 C--O 1.208 -1.122 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 173.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 m -65.51 -35.73 81.73 Favored 'General case' 0 N--CA 1.433 -1.321 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.496 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.84 -42.75 76.23 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 122.055 0.931 . . . . 0.0 108.505 176.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.825 ' HZ2' ' HB ' ' A' ' 33' ' ' ILE . 22.1 ttmt -61.85 -47.72 83.75 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 113.837 -1.528 . . . . 0.0 111.871 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.412 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.23 -28.84 63.42 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.818 177.028 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -67.95 -47.17 69.39 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.496 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.48 14.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 119.916 -0.714 . . . . 0.0 112.858 -177.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.78 29.41 10.73 Favored Glycine 0 C--N 1.316 -0.575 0 C-N-CA 119.809 -1.186 . . . . 0.0 111.267 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.43 92.11 6.97 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.227 0.537 . . . . 0.0 110.138 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 50.2 tp -102.22 -51.99 3.24 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.817 0.341 . . . . 0.0 111.024 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -158.78 -66.82 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.589 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.426 HG12 ' HB2' ' A' ' 27' ' ' MET . 49.3 mm -105.97 114.36 62.72 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.681 0.277 . . . . 0.0 111.146 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.485 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 58.3 Cg_endo -72.38 145.28 42.7 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.672 2.248 . . . . 0.0 111.896 175.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.485 ' HD3' ' HA ' ' A' ' 73' ' ' PRO . 31.9 Cg_exo -59.32 132.72 48.12 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.874 2.382 . . . . 0.0 112.714 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -78.61 151.45 77.23 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.941 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.11 -2.41 11.55 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 123.112 2.541 . . . . 0.0 112.856 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.44 131.04 35.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.717 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -80.15 116.49 20.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.699 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.6 ptp85 -128.25 168.79 14.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.502 -176.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 33.3 t 65.15 94.62 0.05 OUTLIER Pre-proline 0 N--CA 1.469 0.486 0 CA-C-N 115.384 -0.825 . . . . 0.0 112.058 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.29 128.33 11.97 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.689 2.259 . . . . 0.0 111.644 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.413 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 23.1 t -151.88 133.76 8.28 Favored Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.972 -178.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 82' ' ' SER . 20.2 Cg_exo -66.04 -49.36 2.11 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.76 2.307 . . . . 0.0 112.187 177.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -119.2 126.4 27.06 Favored Pre-proline 0 CA--C 1.53 0.209 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.436 177.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.13 95.33 0.91 Allowed 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.74 2.293 . . . . 0.0 113.335 -177.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.4 pt -102.07 106.58 20.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.365 174.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -97.06 -54.36 3.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.52 -172.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.618 HD22 ' H ' ' A' ' 90' ' ' GLU . 2.0 p-10 -72.16 179.32 3.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.018 0.437 . . . . 0.0 111.977 -173.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 55.6 m -69.24 -19.62 63.95 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.706 -177.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.618 ' H ' HD22 ' A' ' 88' ' ' ASN . 35.5 mt-10 66.75 -171.02 0.19 Allowed 'General case' 0 N--CA 1.468 0.426 0 O-C-N 123.535 0.522 . . . . 0.0 111.54 177.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 79.12 -118.99 4.92 Favored Glycine 0 C--N 1.331 0.26 0 C-N-CA 121.072 -0.585 . . . . 0.0 112.786 178.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.7 pttm -110.06 -57.28 2.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.571 0.224 . . . . 0.0 111.123 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -98.86 103.12 15.04 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.991 0.424 . . . . 0.0 110.809 178.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.449 ' H ' ' HG ' ' A' ' 94' ' ' LEU . 1.6 pp -93.74 -12.57 28.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.662 178.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -100.61 94.06 5.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.263 0.554 . . . . 0.0 111.06 -179.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -153.39 -50.19 0.1 Allowed 'General case' 0 N--CA 1.435 -1.179 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.707 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.23 -52.44 16.41 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.191 -0.943 . . . . 0.0 109.603 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.456 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.4 mp0 -53.33 -51.75 61.37 Favored 'General case' 0 CA--C 1.503 -0.836 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.629 -178.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -66.62 -38.71 87.5 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 113.417 -1.719 . . . . 0.0 110.686 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.526 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.99 -44.45 94.5 Favored 'General case' 0 CA--C 1.511 -0.528 0 O-C-N 123.209 0.318 . . . . 0.0 110.363 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.717 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.4 m -68.99 -50.08 52.11 Favored 'General case' 0 N--CA 1.428 -1.54 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.629 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.44 -41.32 93.61 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -175.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.02 -39.1 89.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.547 0.213 . . . . 0.0 110.432 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.532 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.22 -40.15 89.13 Favored 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.717 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.7 mt -63.99 -41.02 97.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.641 178.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.6 mt-10 -65.06 -34.39 78.3 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.798 178.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.4 -34.36 74.37 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 177.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.46 -48.76 76.36 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 175.502 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.54 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.37 -45.41 94.49 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.405 179.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.28 -37.47 85.65 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.939 -178.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.76 -43.81 85.7 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.5 mt -72.17 -38.58 69.1 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.749 177.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.54 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.0 mm -57.49 -50.79 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 110.507 -0.182 . . . . 0.0 110.507 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.9 m -60.84 -39.37 88.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.212 0.529 . . . . 0.0 110.523 -179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.609 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -68.0 -49.59 60.66 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.02 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.3 -37.21 84.88 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.5 t -65.41 -36.9 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-O 121.171 0.51 . . . . 0.0 109.657 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.69 -40.69 79.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.2 0.524 . . . . 0.0 110.238 177.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.0 mt -71.41 -40.56 70.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.118 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.66 111.14 12.43 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.957 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.73 -22.64 36.97 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.78 2.32 . . . . 0.0 112.545 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.38 0.23 55.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.337 0.589 . . . . 0.0 111.151 -177.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -65.02 134.63 54.29 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.623 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.34 109.17 62.91 Favored Pre-proline 0 CA--C 1.509 -0.622 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.276 177.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -68.31 157.97 59.53 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.317 2.011 . . . . 0.0 111.456 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.69 154.44 25.73 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 123.634 2.889 . . . . 0.0 111.711 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.95 -30.41 69.7 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 114.36 1.245 . . . . 0.0 114.36 -173.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -85.54 3.49 40.31 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 123.716 0.635 . . . . 0.0 111.481 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -69.71 127.42 32.89 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.875 0.369 . . . . 0.0 110.644 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -103.55 125.81 33.82 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.701 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.433 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 37.2 Cg_endo -66.13 151.47 83.6 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.625 2.216 . . . . 0.0 112.474 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 31.2 Cg_exo -60.03 135.35 62.17 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.003 2.469 . . . . 0.0 112.566 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -106.32 -44.95 4.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.622 -177.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.4 m -86.73 113.0 22.21 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.955 0.407 . . . . 0.0 111.493 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.9 mtm180 -118.57 119.2 33.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.417 177.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 9.6 p -102.94 139.78 22.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.142 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 26.9 p -139.43 158.8 43.51 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.073 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -112.87 140.86 47.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.87 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -148.55 118.69 7.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.606 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.5 p -151.91 130.55 2.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.429 175.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 22.1 ptm -123.8 167.83 13.54 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.037 0.446 . . . . 0.0 111.73 -176.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 66.6 mt -112.51 114.94 49.82 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 177.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.29 158.03 57.53 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.73 2.286 . . . . 0.0 113.007 -177.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -86.02 160.01 19.44 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.869 179.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.159 -0.924 . . . . 0.0 110.852 -179.901 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.224 0 N-CA-C 112.662 -0.175 . . . . 0.0 112.662 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 373' ' ' HIS . . . . . 0.425 ' ND1' ' HG2' ' A' ' 42' ' ' PRO . 32.2 m80 -119.78 114.93 33.82 Favored Pre-proline 0 C--N 1.332 -0.19 0 CA-C-O 120.503 0.192 . . . . 0.0 111.148 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.95 134.65 44.15 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.866 2.378 . . . . 0.0 111.699 175.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 375' ' ' THR . . . . . 0.46 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -126.29 -71.35 0.69 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.55 -0.295 . . . . 0.0 111.165 -174.72 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 376' ' ' GLU . . . . . 0.494 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.9 0.01 OUTLIER 'General case' 0 C--O 1.231 0.095 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 377' ' ' VAL . . . . . 0.561 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.7 150.89 8.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.458 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 378' ' ' LEU . . . . . 0.626 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.57 152.53 20.86 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.276 -179.078 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 379' ' ' CYS . . . . . 0.609 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.49 142.53 46.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.684 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.508 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.71 101.84 5.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.953 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 2.6 tmm? -117.86 166.49 12.42 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.45 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 382' ' ' ASN . . . . . 0.524 HD21 HE22 ' A' ' 57' ' ' GLN . 13.2 t30 57.8 51.18 9.52 Favored 'General case' 0 CA--C 1.528 0.105 0 O-C-N 123.599 0.562 . . . . 0.0 111.415 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 383' ' ' MET . . . . . 0.812 ' HB3' HG12 ' B' ' 459' ' ' VAL . 3.0 ptm -164.85 14.33 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.236 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 384' ' ' VAL . . . . . 0.743 HG21 HG23 ' B' ' 432' ' ' ILE . 0.4 OUTLIER -152.27 125.17 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.86 0.362 . . . . 0.0 111.308 179.876 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.72 151.76 43.05 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.396 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.16 -23.47 73.05 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.286 1.991 . . . . 0.0 112.294 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.91 -5.52 53.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.45 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.69 5.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.928 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 389' ' ' LEU . . . . . 0.477 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.98 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.595 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 390' ' ' LEU . . . . . 0.557 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.62 -15.69 5.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.605 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.3 148.83 23.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.606 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -73.64 -30.23 62.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.16 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.33 -47.61 26.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.997 0.427 . . . . 0.0 110.833 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.59 -44.23 91.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.841 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.37 -59.43 4.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.181 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -27.25 61.5 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.196 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.2 -41.05 67.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.401 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 398' ' ' ILE . . . . . 0.496 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.83 -53.65 16.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.542 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 399' ' ' VAL . . . . . 0.62 HG22 HD12 ' B' ' 417' ' ' ILE . 59.7 t -53.32 -46.91 58.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.817 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.5 -59.94 3.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.526 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.67 -57.14 11.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.369 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.13 -32.88 15.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.303 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 403' ' ' ARG . . . . . 0.46 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.19 -57.36 4.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.751 0.31 . . . . 0.0 111.166 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.92 -33.66 64.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.171 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 405' ' ' GLU . . . . . 0.552 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.43 -47.1 44.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.83 -23.96 67.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.13 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.14 30.28 1.12 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.932 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.08 -17.06 12.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.74 -15.45 14.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.558 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.19 -139.45 4.15 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.573 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.24 132.46 56.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.697 0.284 . . . . 0.0 111.113 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 412' ' ' VAL . . . . . 0.424 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.39 115.48 48.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 121.012 0.434 . . . . 0.0 110.543 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . 0.703 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.6 -61.96 2.06 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.248 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -153.04 -169.43 3.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.103 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 415' ' ' ILE . . . . . 0.616 HG23 HG12 ' B' ' 434' ' ' VAL . 48.3 mt -145.05 128.96 12.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.849 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 416' ' ' GLU . . . . . 0.422 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.91 108.84 18.76 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.702 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 417' ' ' ILE . . . . . 1.0 HG23 HG21 ' B' ' 432' ' ' ILE . 60.7 mt -128.52 108.62 19.07 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.637 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 418' ' ' PRO . . . . . 0.629 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.49 147.56 9.0 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.709 2.273 . . . . 0.0 112.87 -179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 419' ' ' ARG . . . . . 0.557 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.89 74.64 21.97 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.194 179.875 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -47.14 117.04 1.99 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.739 2.293 . . . . 0.0 112.504 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 421' ' ' VAL . . . . . 0.598 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.7 t -74.28 97.8 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.22 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.57 21.74 8.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.482 0.658 . . . . 0.0 109.348 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 423' ' ' GLY . . . . . 0.645 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.4 29.21 6.07 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.263 -179.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 424' ' ' VAL . . . . . 0.598 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.45 -37.59 30.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.83 35.9 4.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.844 0.355 . . . . 0.0 111.849 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 426' ' ' VAL . . . . . 0.675 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.22 -44.75 49.35 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.839 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 427' ' ' PRO . . . . . 0.675 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.1 Cg_endo -66.33 77.16 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.537 2.158 . . . . 0.0 111.018 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.21 -15.43 3.23 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.367 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.5 149.37 50.26 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 120.615 0.245 . . . . 0.0 110.79 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.15 5.06 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.838 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.52 126.1 44.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.899 0.38 . . . . 0.0 111.0 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 432' ' ' ILE . . . . . 1.0 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -130.98 172.92 15.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.256 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 433' ' ' PHE . . . . . 0.609 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.34 2.79 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.954 -178.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 434' ' ' VAL . . . . . 0.616 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.85 141.73 41.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.188 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 435' ' ' GLU . . . . . 0.485 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.41 108.53 17.27 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.752 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.83 168.39 12.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.256 -179.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 437' ' ' THR . . . . . 0.703 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.4 p -94.97 -45.4 7.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.451 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.87 146.67 52.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.07 0.462 . . . . 0.0 111.26 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.21 -12.77 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.165 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.62 -54.8 26.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.09 0.471 . . . . 0.0 110.096 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.14 -29.52 60.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.818 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.22 -31.68 72.26 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.22 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.66 -48.0 15.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.682 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.62 -12.03 59.52 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.738 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -55.28 3.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.949 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 446' ' ' MET . . . . . 0.626 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.2 OUTLIER -64.83 -26.6 68.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.199 -179.313 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.16 -16.2 63.06 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.588 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.62 -8.63 22.52 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.354 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 449' ' ' LEU . . . . . 0.403 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.3 mt -95.69 -20.76 18.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.726 0.298 . . . . 0.0 110.898 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 15.8 p -73.95 126.73 31.1 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.063 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 98.35 -9.06 62.77 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.978 178.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 452' ' ' ARG . . . . . 0.419 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -76.59 -152.21 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.787 0.293 . . . . 0.0 110.505 177.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 453' ' ' LYS . . . . . 0.475 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.1 2.28 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.768 0.318 . . . . 0.0 111.296 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.35 -36.29 75.43 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.515 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.26 -50.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 456' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -157.3 24.86 0.3 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.779 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 457' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.52 135.74 19.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.316 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 13.4 p -59.41 126.94 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 121.273 0.559 . . . . 0.0 111.034 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 459' ' ' VAL . . . . . 0.812 HG12 ' HB3' ' B' ' 383' ' ' MET . 3.7 m -84.86 127.82 39.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.844 -176.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 460' ' ' VAL . . . . . 0.544 ' HA ' ' CB ' ' A' ' 38' ' ' THR . 47.0 t -95.45 92.55 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.117 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.063 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 67.5 p -100.25 128.01 46.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.907 0.384 . . . . 0.0 111.316 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 462' ' ' LYS . . . . . 0.823 ' HG2' ' H ' ' A' ' 40' ' ' ILE . 11.7 mtmt -132.02 -159.67 0.98 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.038 -178.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -113.32 147.02 38.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.53 -179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 464' ' ' CYS . . . . . 0.561 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.88 149.0 47.39 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.049 0.452 . . . . 0.0 111.311 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 465' ' ' ASP . . . . . 0.46 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.33 129.34 66.86 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.405 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 466' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.09 -33.21 72.88 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.708 2.272 . . . . 0.0 112.095 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.06 -58.55 7.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.37 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.33 -33.81 68.11 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.291 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 469' ' ' TYR . . . . . 0.485 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.5 t80 -60.12 -51.18 70.7 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.162 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.42 -47.5 69.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.326 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 471' ' ' ARG . . . . . 0.455 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.17 49.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.39 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.11 20.8 8.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.888 0.375 . . . . 0.0 110.215 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 473' ' ' ASP . . . . . 0.455 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.72 -20.94 24.56 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.978 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -87.47 75.45 9.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.23 0.538 . . . . 0.0 110.541 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 3.3 p-90 . . . . . 0 C--O 1.246 0.917 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.397 178.391 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.9 mtp . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.803 0.335 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -117.27 -29.07 5.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.462 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 11.4 t -145.42 160.95 40.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.801 0.334 . . . . 0.0 111.324 -177.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.81 -0.01 86.16 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.632 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -73.69 147.77 43.32 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.771 0.32 . . . . 0.0 110.948 178.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -85.77 89.95 7.9 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.032 0.444 . . . . 0.0 111.578 -177.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.99 -28.61 18.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.025 174.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.473 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 30.2 p -93.66 127.32 46.37 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.637 176.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 16.2 Cg_exo -69.02 162.85 39.98 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.131 2.554 . . . . 0.0 112.709 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 10' ' ' LEU . 3.6 mm? -63.96 -24.81 67.86 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.096 176.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -83.41 125.84 32.11 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.733 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -100.96 155.24 36.54 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.545 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.77 115.49 2.52 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 122.664 2.243 . . . . 0.0 112.384 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.98 -166.76 1.33 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.904 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.34 51.97 12.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.892 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.41 -36.15 3.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.002 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.79 91.85 2.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.863 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.93 -54.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.799 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.87 111.13 13.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.005 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.93 125.69 25.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.735 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.67 12.73 19.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.961 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.612 ' HZ3' HG11 ' B' ' 459' ' ' VAL . 71.6 m95 -141.97 52.97 1.48 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.766 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.15 -156.59 0.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.928 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.478 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.3 -37.65 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.76 121.26 42.76 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 118.951 -0.547 . . . . 0.0 110.64 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.599 ' HB ' ' HA3' ' A' ' 71' ' ' GLY . 59.3 p -118.25 175.88 5.49 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 123.266 0.353 . . . . 0.0 110.904 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.475 ' HB3' ' H ' ' A' ' 28' ' ' GLU . 4.8 tpt 53.17 -96.86 0.06 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.698 0.623 . . . . 0.0 112.323 176.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.475 ' H ' ' HB3' ' A' ' 27' ' ' MET . 18.3 mt-10 -97.48 135.32 39.51 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.273 -178.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -97.72 99.83 11.2 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.154 175.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -111.85 -67.13 1.02 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.633 -176.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.9 t -125.35 138.88 54.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.238 0.542 . . . . 0.0 111.901 -176.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -112.97 94.1 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.844 175.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.95 123.35 30.31 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 121.297 0.57 . . . . 0.0 111.398 -176.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -78.11 118.21 4.32 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.691 2.26 . . . . 0.0 112.596 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 161.27 56.21 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.935 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 7.1 ptm -134.72 74.16 65.47 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.08 0.467 . . . . 0.0 110.749 177.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -81.41 142.46 13.21 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 123.215 2.61 . . . . 0.0 112.265 -178.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.593 ' HB ' HG22 ' B' ' 460' ' ' VAL . 15.4 p -115.84 -25.04 7.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.979 -178.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 22.1 m -60.69 125.98 17.77 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-O 121.388 0.613 . . . . 0.0 111.659 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.536 HD11 HG13 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -79.39 132.87 61.1 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.992 -177.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' A' ' 42' ' ' PRO . 54.5 Cg_endo -71.49 132.88 21.36 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.024 2.483 . . . . 0.0 112.744 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 29.8 Cg_exo -62.0 125.75 17.22 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.965 2.444 . . . . 0.0 112.642 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 114.45 50.98 0.48 Allowed Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.575 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.447 HD22 ' O ' ' A' ' 41' ' ' PRO . 1.5 pt? -152.45 -169.01 3.22 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 120.72 0.295 . . . . 0.0 110.968 -179.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.596 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 40.3 p -119.35 170.04 9.47 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.493 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.526 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -62.0 -31.32 71.68 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.297 178.74 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.596 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.32 -44.99 61.89 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.43 -33.27 72.72 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.631 -176.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.505 ' HG3' ' CD1' ' A' ' 40' ' ' ILE . 22.4 tt0 -57.8 -48.23 80.3 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.095 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.554 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.62 -43.41 98.88 Favored 'General case' 0 C--O 1.186 -2.285 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.236 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.546 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.44 -40.08 81.57 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.782 0.676 . . . . 0.0 111.557 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -67.57 -45.79 74.55 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.021 175.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.606 HG23 HG21 ' B' ' 460' ' ' VAL . 95.8 mt -61.68 -49.14 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.782 177.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 50' ' ' ARG . 34.9 m -67.51 -35.54 73.55 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.776 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.916 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.15 -44.58 92.09 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.568 0.622 . . . . 0.0 110.319 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.5 tp -65.29 -35.36 80.77 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.976 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -75.12 -34.6 61.71 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.656 176.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.463 HD13 HD13 ' A' ' 113' ' ' ILE . 72.8 mt -63.05 -46.91 94.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.401 0.68 . . . . 0.0 110.433 177.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.41 -41.39 84.94 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.668 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -67.68 -34.01 76.06 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.404 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.529 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.48 -45.02 77.12 Favored 'General case' 0 C--O 1.207 -1.181 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 174.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.1 m -65.43 -35.86 82.2 Favored 'General case' 0 N--CA 1.434 -1.275 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.498 ' O ' HG22 ' A' ' 67' ' ' THR . 39.1 ttp180 -55.8 -42.73 76.04 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.054 0.931 . . . . 0.0 108.529 176.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.529 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.84 -47.77 83.59 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 113.833 -1.53 . . . . 0.0 111.871 179.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.17 -28.92 63.54 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.758 177.093 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.91 -47.16 69.53 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.498 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.09 -17.52 14.46 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.75 29.47 10.68 Favored Glycine 0 C--N 1.315 -0.605 0 C-N-CA 119.858 -1.163 . . . . 0.0 111.259 -177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.4 92.07 6.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.185 0.517 . . . . 0.0 110.165 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 18.3 tp -105.73 -50.82 3.11 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.503 179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.599 ' HA3' ' HB ' ' A' ' 26' ' ' THR . . . 79.48 -96.61 1.52 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.227 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.5 HD11 HD22 ' B' ' 456' ' ' ASN . 17.8 pt -84.16 135.97 41.32 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 120.789 0.328 . . . . 0.0 110.794 177.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -68.97 162.57 41.1 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.794 2.33 . . . . 0.0 112.505 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.84 -2.34 10.07 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.762 2.308 . . . . 0.0 112.741 177.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -73.88 144.84 83.2 Favored Pre-proline 0 C--O 1.232 0.183 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.767 177.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.84 -50.53 10.13 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.049 2.499 . . . . 0.0 112.682 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -151.2 99.94 2.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.005 0.431 . . . . 0.0 110.657 178.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -100.4 108.77 20.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.083 177.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -87.79 -54.39 4.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.043 -177.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 70.3 m -134.09 141.69 40.48 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.204 -178.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 80' ' ' SER . 23.9 Cg_exo -65.68 153.69 77.06 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.215 2.61 . . . . 0.0 112.716 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 63.5 m -85.99 139.83 34.88 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.294 -178.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -80.53 173.82 11.88 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.838 2.359 . . . . 0.0 112.555 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -151.29 111.41 3.03 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.562 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -69.53 -33.45 17.41 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.764 2.309 . . . . 0.0 113.314 -178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 11.2 tt -106.96 127.6 62.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-O 121.201 0.524 . . . . 0.0 111.699 -178.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 37.6 p90 -103.75 149.75 24.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.467 177.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -134.3 113.16 11.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.145 0.497 . . . . 0.0 111.112 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 36.3 t -74.68 -34.49 62.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.329 176.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -126.45 124.98 41.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.541 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 169.95 23.89 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.93 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 10.2 mmtp -129.88 126.79 38.8 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.028 0.442 . . . . 0.0 111.25 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -136.18 -50.97 0.7 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.39 179.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 33.3 mt -101.97 146.2 28.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.759 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -86.29 160.13 19.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.271 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.2 t -168.51 -50.13 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -177.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.19 -52.43 16.55 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.329 -0.857 . . . . 0.0 109.693 -178.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.464 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.5 mp0 -53.27 -51.83 60.98 Favored 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 113.655 -1.611 . . . . 0.0 110.633 -178.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -66.67 -38.64 87.24 Favored 'General case' 0 N--CA 1.428 -1.535 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.686 -177.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.96 -44.46 94.42 Favored 'General case' 0 CA--C 1.51 -0.566 0 O-C-N 123.197 0.311 . . . . 0.0 110.385 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.711 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.9 m -69.06 -50.04 51.98 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.617 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.4 -41.28 93.82 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.95 -39.23 90.27 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 178.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.535 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.27 -40.06 89.04 Favored 'General case' 0 C--O 1.225 -0.225 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.711 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.4 mt -64.07 -40.94 97.37 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.648 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.12 -34.3 78.08 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.75 178.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.5 -34.39 74.23 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.4 -48.81 76.29 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.561 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.3 -45.55 94.01 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.39 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.14 -37.47 85.31 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 123.594 0.758 . . . . 0.0 111.004 -178.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.85 -43.76 86.13 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.4 mt -72.23 -38.57 68.92 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.773 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.561 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.38 -50.9 75.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 N-CA-C 110.514 -0.18 . . . . 0.0 110.514 179.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.7 m -60.71 -39.46 88.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.276 0.56 . . . . 0.0 110.551 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -68.0 -49.51 61.16 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.97 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.11 84.49 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -177.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.6 t -65.63 -36.85 78.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.53 -40.72 80.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.257 0.551 . . . . 0.0 110.299 177.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.5 mt -71.52 -40.6 70.0 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.982 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -133.64 111.23 12.47 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 116.3 -0.409 . . . . 0.0 109.929 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.78 -22.61 36.66 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.779 2.319 . . . . 0.0 112.62 -178.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.29 0.06 55.98 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.409 0.623 . . . . 0.0 111.179 -177.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.91 134.64 54.42 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.606 -178.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.39 109.13 62.86 Favored Pre-proline 0 CA--C 1.509 -0.619 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.278 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.31 157.95 59.65 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.306 2.004 . . . . 0.0 111.507 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.67 154.52 25.35 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 123.589 2.859 . . . . 0.0 111.724 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.0 -31.11 70.57 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -173.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -86.15 32.89 0.61 Allowed 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.765 0.666 . . . . 0.0 111.626 -177.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 9.3 p90 -86.31 149.45 25.04 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.591 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.403 ' HA ' ' HD2' ' A' ' 131' ' ' PRO . 31.6 ttpt -126.97 115.82 22.06 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 177.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 130' ' ' LYS . 49.6 Cg_endo -68.35 158.86 55.8 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.855 2.37 . . . . 0.0 112.1 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -56.57 -62.43 0.24 Allowed 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.901 2.401 . . . . 0.0 112.216 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -125.23 -52.65 1.63 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.085 175.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 14.8 t -164.35 155.61 15.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.209 178.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -70.04 133.68 47.46 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.907 0.384 . . . . 0.0 110.746 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 12.8 t -69.32 127.23 30.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.142 -176.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.411 ' HA ' HG12 ' A' ' 140' ' ' VAL . 73.2 m 61.42 46.63 7.43 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.354 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -123.46 -15.43 7.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.618 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 7.4 ttpm? -119.03 -29.94 5.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.824 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' A' ' 137' ' ' CYS . 8.4 p -79.7 143.16 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.07 -179.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 4.3 mpp? -94.41 169.84 9.92 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.272 -178.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.454 ' HB ' ' HD2' ' A' ' 143' ' ' PRO . 28.5 pt -94.43 159.84 32.99 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.155 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.454 ' HD2' ' HB ' ' A' ' 142' ' ' ILE . 27.9 Cg_endo -62.95 138.87 70.61 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.694 2.262 . . . . 0.0 112.237 178.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -89.47 155.76 19.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.92 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.427 -0.797 . . . . 0.0 110.986 -178.878 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.194 0 N-CA-C 112.571 -0.211 . . . . 0.0 112.571 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 -122.05 101.1 42.13 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-O 120.709 0.29 . . . . 0.0 111.031 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.34 148.08 23.51 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.678 2.252 . . . . 0.0 112.696 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 375' ' ' THR . . . . . 0.463 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -129.5 -71.32 0.62 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.217 179.161 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 376' ' ' GLU . . . . . 0.495 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.93 0.01 OUTLIER 'General case' 0 C--O 1.232 0.133 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 377' ' ' VAL . . . . . 0.56 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.62 150.99 7.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.402 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 378' ' ' LEU . . . . . 0.506 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.67 152.51 20.82 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.17 -179.085 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 379' ' ' CYS . . . . . 0.584 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.53 142.53 46.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.662 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.513 HD11 HG13 ' B' ' 434' ' ' VAL . 5.4 mt -132.71 101.9 5.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.96 -179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 91.4 mtp -117.36 166.89 11.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.849 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 382' ' ' ASN . . . . . . . . . . . . . 13.3 t30 57.46 51.2 10.08 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 123.649 0.593 . . . . 0.0 111.273 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 383' ' ' MET . . . . . 0.438 ' SD ' ' HB3' ' B' ' 380' ' ' LEU . 3.0 ptm -164.83 14.4 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.228 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 384' ' ' VAL . . . . . 0.697 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.25 125.06 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.721 0.296 . . . . 0.0 111.394 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.404 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.72 151.77 43.06 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.431 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.23 -23.43 72.57 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.351 2.034 . . . . 0.0 112.237 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.95 -5.51 53.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.477 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.05 -36.73 5.78 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.888 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 389' ' ' LEU . . . . . 0.472 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.4 mt -82.87 34.86 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.932 0.396 . . . . 0.0 110.607 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 390' ' ' LEU . . . . . 0.544 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.51 -15.76 5.51 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.674 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.29 148.74 23.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.551 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -73.58 -30.27 62.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.168 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 32.8 mm-40 -75.25 -47.76 26.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.998 0.428 . . . . 0.0 110.743 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.54 -44.25 91.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.826 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.37 -59.37 5.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.214 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.29 61.58 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.203 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.14 -41.02 67.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.402 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 398' ' ' ILE . . . . . 0.494 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.94 -53.69 15.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.474 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 399' ' ' VAL . . . . . 0.614 HG22 HD12 ' B' ' 417' ' ' ILE . 59.5 t -53.22 -46.98 57.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.801 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.92 3.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.517 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.73 -57.16 11.84 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.331 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.1 -32.84 15.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.385 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 403' ' ' ARG . . . . . 0.451 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.27 -57.39 4.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.12 -179.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.92 -33.59 64.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.15 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 405' ' ' GLU . . . . . 0.535 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.41 -47.17 44.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.95 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.78 -24.0 67.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.163 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.11 30.45 1.09 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.963 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.18 -17.14 12.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.821 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.66 -15.47 14.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.489 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.42 4.15 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.571 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 411' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.24 132.52 56.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.676 0.275 . . . . 0.0 111.052 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 412' ' ' VAL . . . . . 0.423 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.45 115.41 48.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.084 0.469 . . . . 0.0 110.549 179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . 0.673 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.61 -62.06 1.99 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.168 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.96 -169.38 3.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.167 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 415' ' ' ILE . . . . . 0.614 HG23 HG12 ' B' ' 434' ' ' VAL . 48.5 mt -145.13 128.96 12.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.831 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 416' ' ' GLU . . . . . 0.433 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.9 108.82 18.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.733 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 417' ' ' ILE . . . . . 0.974 HG23 HG21 ' B' ' 432' ' ' ILE . 60.8 mt -128.55 108.57 19.01 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.644 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 418' ' ' PRO . . . . . 0.633 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.45 147.61 8.86 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.644 2.229 . . . . 0.0 112.916 -179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 419' ' ' ARG . . . . . 0.544 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.92 74.79 21.71 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.124 179.81 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -47.25 117.06 2.04 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.729 2.286 . . . . 0.0 112.472 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 421' ' ' VAL . . . . . 0.596 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.3 t -74.4 97.86 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.12 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.55 21.71 8.92 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.582 0.706 . . . . 0.0 109.374 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 423' ' ' GLY . . . . . 0.623 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.41 29.23 6.06 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.253 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 424' ' ' VAL . . . . . 0.596 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.48 -37.57 30.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.102 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.86 35.87 4.78 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.798 0.332 . . . . 0.0 111.809 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 426' ' ' VAL . . . . . 0.675 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.35 -44.68 47.72 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.775 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 427' ' ' PRO . . . . . 0.675 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.27 77.09 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.532 2.155 . . . . 0.0 111.08 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.27 -15.36 3.22 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.349 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.57 149.36 50.22 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.554 0.216 . . . . 0.0 110.864 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.17 5.06 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.842 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.4 126.04 44.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.856 0.36 . . . . 0.0 111.11 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 432' ' ' ILE . . . . . 0.974 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -130.95 172.84 15.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.28 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 433' ' ' PHE . . . . . 0.584 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.43 -176.36 2.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.981 0.419 . . . . 0.0 112.027 -178.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 434' ' ' VAL . . . . . 0.614 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.79 141.76 41.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.211 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 435' ' ' GLU . . . . . 0.492 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.36 108.39 17.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.849 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.72 168.4 12.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.255 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 437' ' ' THR . . . . . 0.673 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.91 -45.44 7.28 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.455 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.87 146.59 52.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.028 0.442 . . . . 0.0 111.249 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.15 -12.74 16.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.238 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -54.79 26.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.015 0.436 . . . . 0.0 110.087 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -75.08 -29.54 60.7 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.829 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.2 -31.71 72.27 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.197 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.61 -48.12 15.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.666 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.55 -12.11 59.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.73 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.83 -55.34 3.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.946 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 446' ' ' MET . . . . . 0.506 ' HB3' HD21 ' B' ' 378' ' ' LEU . 3.3 ptm -65.02 -25.86 68.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.22 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -70.8 -16.2 62.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.606 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.62 22.55 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.418 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 449' ' ' LEU . . . . . 0.407 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.66 -19.72 19.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.818 0.342 . . . . 0.0 110.99 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 16.0 m -72.85 125.94 28.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.206 -0.907 . . . . 0.0 111.038 176.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 98.5 -9.12 62.48 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.946 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 452' ' ' ARG . . . . . 0.433 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.83 -152.15 0.05 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.865 0.332 . . . . 0.0 110.553 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 453' ' ' LYS . . . . . 0.478 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.81 117.13 2.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.791 0.329 . . . . 0.0 111.263 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.33 -36.33 75.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.55 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.22 -50.92 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.754 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 456' ' ' ASN . . . . . 0.5 HD22 HD11 ' A' ' 72' ' ' ILE . 6.4 p30 -157.23 24.89 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.834 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 457' ' ' ARG . . . . . 0.419 ' NE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.41 132.39 16.19 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.253 179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 5.6 p -66.37 112.64 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.552 0.691 . . . . 0.0 110.994 -177.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 459' ' ' VAL . . . . . 0.612 HG11 ' HZ3' ' A' ' 22' ' ' TRP . 1.9 p -73.0 124.03 29.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.736 -174.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 460' ' ' VAL . . . . . 0.606 HG21 HG23 ' A' ' 53' ' ' ILE . 66.9 t -92.55 102.53 13.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.868 178.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 72.8 p -92.82 153.91 18.57 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.744 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 462' ' ' LYS . . . . . 0.41 ' HE2' ' HB2' ' B' ' 462' ' ' LYS . 0.1 OUTLIER -151.75 -168.41 3.07 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.082 0.468 . . . . 0.0 111.266 -177.714 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.44 146.91 37.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.411 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 464' ' ' CYS . . . . . 0.56 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 148.98 47.43 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.071 0.463 . . . . 0.0 111.363 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 465' ' ' ASP . . . . . 0.463 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.32 129.32 66.96 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.377 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 466' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.3 Cg_endo -53.96 -33.32 71.95 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.708 2.272 . . . . 0.0 112.148 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.51 7.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.385 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.81 68.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.289 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 469' ' ' TYR . . . . . 0.492 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.0 -51.28 70.33 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.161 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.38 -47.51 69.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.335 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 471' ' ' ARG . . . . . 0.448 HH11 ' HD2' ' B' ' 471' ' ' ARG . 0.0 OUTLIER -81.68 -2.18 49.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.438 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.1 20.77 8.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.007 0.432 . . . . 0.0 110.282 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 473' ' ' ASP . . . . . 0.436 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.62 -21.82 29.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.96 179.835 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 49.3 p90 43.58 33.48 0.67 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.652 1.181 . . . . 0.0 112.856 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 20.5 t90 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.184 -0.913 . . . . 0.0 110.637 179.572 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.4 mmm . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.88 0.372 . . . . 0.0 110.938 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -83.89 -25.87 29.85 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.19 178.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 30.1 p 52.66 -158.6 0.13 Allowed 'General case' 0 N--CA 1.474 0.756 0 O-C-N 123.977 0.798 . . . . 0.0 112.566 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 98.23 77.84 1.36 Allowed Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.62 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -99.76 52.09 0.92 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.973 0.416 . . . . 0.0 110.825 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.411 HD22 ' HA ' ' A' ' 6' ' ' ASN . 2.7 t-20 -92.55 -42.81 9.48 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.106 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -135.38 172.85 12.43 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.845 0.355 . . . . 0.0 111.536 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.432 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 25.6 m -106.35 123.6 38.37 Favored Pre-proline 0 CA--C 1.53 0.184 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.883 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 23.4 Cg_exo -64.66 151.97 83.64 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.058 2.506 . . . . 0.0 113.005 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 97.6 mt -112.82 -167.38 1.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.881 179.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -92.96 167.26 11.93 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.319 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -108.5 151.84 41.79 Favored Pre-proline 0 CA--C 1.531 0.223 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.935 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -57.29 115.49 2.54 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.993 2.462 . . . . 0.0 112.407 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.01 -166.7 1.32 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.836 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.31 51.96 12.22 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.935 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.43 -36.18 3.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.996 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.92 2.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.89 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.93 -54.26 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.734 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.89 111.13 13.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.57 24.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.816 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.84 19.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.038 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.602 ' HZ3' HG21 ' B' ' 459' ' ' VAL . 71.7 m95 -142.02 53.05 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.806 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.2 -156.59 0.13 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.889 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.467 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.27 -37.7 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.897 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.454 ' O ' ' HB ' ' A' ' 26' ' ' THR . 0.2 OUTLIER -114.72 125.72 54.05 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 118.826 -0.607 . . . . 0.0 110.607 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.587 ' H ' ' HA ' ' A' ' 29' ' ' GLN . 88.3 m 101.38 146.71 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 O-C-N 124.615 1.197 . . . . 0.0 110.778 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.571 ' HG2' ' HB3' ' B' ' 456' ' ' ASN . 24.2 ttt 79.43 -29.46 0.14 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.375 1.07 . . . . 0.0 110.452 -173.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -142.09 -26.17 0.65 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 173.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.587 ' HA ' ' H ' ' A' ' 26' ' ' THR . 0.5 OUTLIER 59.92 88.01 0.08 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.001 -1.0 . . . . 0.0 112.493 176.257 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.648 ' HG3' HH22 ' A' ' 63' ' ' ARG . 23.7 ttmm -124.3 95.76 4.66 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.48 174.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 26.9 p -66.97 -56.2 11.2 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.057 -173.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 8.4 p -90.42 140.33 16.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.889 0.375 . . . . 0.0 110.741 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.429 ' HB ' ' HD2' ' A' ' 34' ' ' PRO . 1.0 OUTLIER -70.35 162.63 68.76 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.128 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.429 ' HD2' ' HB ' ' A' ' 33' ' ' ILE . 78.2 Cg_exo -51.38 136.43 47.52 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.909 2.406 . . . . 0.0 112.629 178.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.86 -43.99 98.46 Favored Glycine 0 C--N 1.334 0.417 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.847 -178.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 70.7 mtm -109.88 150.22 41.06 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.503 0.192 . . . . 0.0 110.714 178.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -58.72 156.62 31.56 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 123.039 2.493 . . . . 0.0 112.644 178.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.505 ' HB ' HG13 ' B' ' 460' ' ' VAL . 43.3 p -99.59 -22.14 15.58 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.143 -176.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 28.4 m -59.22 129.69 21.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.799 -176.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.913 ' HB ' ' HD3' ' B' ' 462' ' ' LYS . 62.6 mt -115.44 125.85 28.38 Favored Pre-proline 0 CA--C 1.533 0.313 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.827 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 42' ' ' PRO . 25.5 Cg_endo -61.19 158.74 33.52 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.696 2.93 . . . . 0.0 113.922 -175.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 1.6 Cg_endo -81.42 108.89 2.01 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 123.436 2.758 . . . . 0.0 112.849 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 136.25 28.76 0.36 Allowed Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.396 178.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -110.22 171.24 7.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.998 0.428 . . . . 0.0 111.168 -175.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.587 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 1.5 p -99.38 149.15 23.46 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.334 174.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.492 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -58.64 -31.32 68.02 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.329 -178.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.587 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.33 -45.18 61.06 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.16 -33.1 72.88 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.761 -177.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.754 ' HG2' HG21 ' A' ' 40' ' ' ILE . 51.1 mt-10 -61.24 -44.75 96.75 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.225 178.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.556 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -62.89 -43.39 98.93 Favored 'General case' 0 C--O 1.185 -2.316 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.248 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.553 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.26 -41.09 83.5 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 123.789 0.681 . . . . 0.0 111.626 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.79 -46.8 80.57 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.024 175.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.603 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 96.5 mt -64.49 -46.94 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.013 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 50' ' ' ARG . 34.9 m -68.04 -35.59 72.3 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.806 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.914 -177.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.12 -44.22 91.98 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.515 0.598 . . . . 0.0 110.349 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 1.7 pp -70.17 -28.55 65.42 Favored 'General case' 0 C--N 1.344 0.367 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.713 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.451 ' NE2' HD21 ' B' ' 382' ' ' ASN . 91.3 mt-30 -77.86 -34.68 51.64 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-O 120.873 0.368 . . . . 0.0 110.167 176.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.483 HD13 HD13 ' A' ' 113' ' ' ILE . 72.5 mt -62.9 -46.94 95.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.382 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.463 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.48 -41.28 84.84 Favored 'General case' 0 CA--C 1.514 -0.438 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.703 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -68.31 -33.35 74.16 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.199 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.531 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.47 -44.98 77.28 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 173.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 m -65.63 -35.61 81.29 Favored 'General case' 0 N--CA 1.433 -1.305 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -178.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.648 HH22 ' HG3' ' A' ' 30' ' ' LYS . 39.1 ttp180 -55.82 -42.86 76.33 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 122.068 0.937 . . . . 0.0 108.495 176.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.531 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.71 -47.78 83.72 Favored 'General case' 0 N--CA 1.432 -1.351 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.873 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.418 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.18 -28.86 63.49 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.856 177.028 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -67.97 -47.12 69.45 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.49 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.5 14.46 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -177.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.72 29.43 10.76 Favored Glycine 0 C--N 1.316 -0.57 0 C-N-CA 119.916 -1.135 . . . . 0.0 111.295 -177.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -82.34 88.85 6.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.258 0.552 . . . . 0.0 110.094 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 26.5 tp -130.16 -30.96 1.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.544 176.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 116.56 -133.1 10.51 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.792 -0.718 . . . . 0.0 113.054 177.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 5.9 tt -130.03 125.59 22.05 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 120.939 0.4 . . . . 0.0 111.364 -176.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.2 128.31 12.83 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.505 2.137 . . . . 0.0 111.826 175.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -62.8 -49.68 5.01 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.959 2.439 . . . . 0.0 112.748 -178.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.411 ' HA ' ' HD3' ' A' ' 76' ' ' PRO . 6.5 p30 -133.41 134.92 24.41 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.271 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 75' ' ' ASN . 10.0 Cg_exo -72.0 132.89 20.54 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.835 2.356 . . . . 0.0 111.958 176.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.79 137.34 45.74 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.991 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.07 140.28 54.86 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.056 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 -86.11 153.14 22.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.576 -178.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.0 p -144.33 136.74 13.36 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 177.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -62.38 129.23 26.06 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.452 2.102 . . . . 0.0 112.212 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.8 m -139.77 104.9 6.89 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.256 -177.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -79.24 -179.56 5.53 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 123.335 2.69 . . . . 0.0 112.458 177.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.472 ' HG3' HD21 ' A' ' 88' ' ' ASN . 22.6 mm-40 -101.69 145.71 30.95 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 178.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 84' ' ' GLU . 32.0 Cg_exo -60.09 -39.2 71.82 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.998 2.465 . . . . 0.0 112.346 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 7.3 pt -109.86 166.41 5.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.917 177.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -92.15 101.17 13.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.108 175.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.472 HD21 ' HG3' ' A' ' 84' ' ' GLU . 8.4 p30 -105.08 143.55 33.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.716 -176.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 56.9 m -75.34 -24.45 57.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.809 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -82.91 161.97 21.69 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.973 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 126.75 59.81 0.14 Allowed Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.755 178.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -102.81 -55.56 2.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.754 0.311 . . . . 0.0 110.583 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -98.6 84.74 3.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.161 0.505 . . . . 0.0 110.186 175.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.1 mt -91.37 131.02 37.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.272 -176.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -118.13 159.78 22.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.185 178.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.1 t -157.8 -50.11 0.07 Allowed 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.787 179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.16 -52.52 16.21 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.247 -0.908 . . . . 0.0 109.692 -178.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.452 ' CD ' ' H ' ' A' ' 98' ' ' GLU . 40.6 mp0 -53.3 -51.67 61.58 Favored 'General case' 0 CA--C 1.502 -0.872 0 CA-C-N 113.614 -1.63 . . . . 0.0 110.714 -178.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -66.78 -38.56 86.8 Favored 'General case' 0 N--CA 1.427 -1.59 0 CA-C-N 113.42 -1.718 . . . . 0.0 110.681 -177.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.523 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.89 -44.57 94.16 Favored 'General case' 0 CA--C 1.512 -0.5 0 O-C-N 123.267 0.355 . . . . 0.0 110.379 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.728 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 16.0 m -69.01 -50.01 52.67 Favored 'General case' 0 N--CA 1.428 -1.561 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.649 179.027 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.449 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.4 -41.36 93.75 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -175.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.01 -39.15 90.02 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 110.381 -0.229 . . . . 0.0 110.381 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.527 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.15 -40.17 88.96 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.728 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.93 -41.02 97.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.719 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.12 -34.39 78.28 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.707 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.31 74.2 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.51 -48.84 75.95 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 175.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.554 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.32 -45.44 94.43 Favored 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 114.453 -1.249 . . . . 0.0 110.404 179.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.3 t-160 -62.21 -37.51 85.6 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 123.603 0.761 . . . . 0.0 110.991 -178.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.84 -43.73 86.06 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.2 mt -72.21 -38.61 68.97 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.753 177.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.554 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.39 -50.86 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 120.464 0.173 . . . . 0.0 110.544 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.3 m -60.63 -39.58 88.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.221 0.534 . . . . 0.0 110.548 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.55 61.04 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.981 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.41 -37.11 84.48 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.3 t -65.49 -36.88 78.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-O 121.19 0.519 . . . . 0.0 109.642 176.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.61 -40.77 80.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.171 0.51 . . . . 0.0 110.26 177.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.2 mt -71.33 -40.69 70.58 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.069 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.401 ' HA ' ' HD2' ' A' ' 121' ' ' PRO . 45.6 t30 -133.53 111.14 12.57 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.323 -0.398 . . . . 0.0 109.992 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 120' ' ' ASN . 59.9 Cg_endo -68.69 -22.72 37.06 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.885 2.39 . . . . 0.0 112.57 -178.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.24 0.04 55.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.35 0.595 . . . . 0.0 111.198 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.85 134.58 54.36 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.673 -178.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.36 109.18 62.91 Favored Pre-proline 0 CA--C 1.509 -0.615 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.308 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.29 157.97 59.52 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.247 1.965 . . . . 0.0 111.419 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.65 154.51 25.28 Favored 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 123.673 2.915 . . . . 0.0 111.737 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.18 -30.31 69.38 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -173.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -85.45 34.11 0.57 Allowed 'General case' 0 CA--C 1.532 0.288 0 O-C-N 123.603 0.564 . . . . 0.0 111.224 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -93.34 129.2 39.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.52 177.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -114.01 128.26 25.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.493 177.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -66.75 160.21 47.61 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.917 2.411 . . . . 0.0 112.293 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.96 -0.82 9.58 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.76 2.306 . . . . 0.0 113.267 178.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -88.11 139.79 30.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.881 0.372 . . . . 0.0 111.205 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 11.1 t -89.43 158.21 17.83 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.089 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 20.2 ttm180 -98.77 139.94 33.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.967 -178.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 16.4 m -98.86 -175.94 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.23 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 53.0 t -123.85 -62.68 1.28 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.458 -178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -70.65 130.17 41.09 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.156 -177.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.401 ' HD2' ' HA ' ' A' ' 139' ' ' LYS . 20.1 tptm 59.96 89.35 0.07 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 123.728 0.643 . . . . 0.0 111.462 -178.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 5.9 m -76.46 137.87 21.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.194 179.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 51.9 ttm -93.6 147.52 22.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.757 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 36.0 mt -67.37 117.14 43.95 Favored Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.785 178.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -69.8 148.77 65.53 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.987 2.458 . . . . 0.0 112.557 -177.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -91.24 102.02 14.73 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.561 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 20.5 t70 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.18 -0.914 . . . . 0.0 111.01 -179.437 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -113.36 117.81 44.7 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.631 0.253 . . . . 0.0 111.105 -178.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.26 157.81 33.43 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.83 2.354 . . . . 0.0 111.756 174.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 375' ' ' THR . . . . . 0.452 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -119.67 -71.33 0.74 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.124 177.903 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 376' ' ' GLU . . . . . 0.49 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.88 -45.96 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 377' ' ' VAL . . . . . 0.564 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.66 150.98 7.95 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.431 -179.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 378' ' ' LEU . . . . . 0.586 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.72 152.54 20.78 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.182 -179.026 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 379' ' ' CYS . . . . . 0.605 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.5 t -115.52 142.6 46.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.623 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.52 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.74 101.27 5.21 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.0 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 43.3 ttm -118.02 165.58 13.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.784 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 382' ' ' ASN . . . . . 0.451 HD21 ' NE2' ' A' ' 57' ' ' GLN . 13.4 t30 59.07 51.22 7.3 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 123.635 0.584 . . . . 0.0 111.273 -178.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 383' ' ' MET . . . . . 0.694 ' HB3' HG12 ' B' ' 459' ' ' VAL . 3.0 ptm -164.89 14.4 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.233 179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 384' ' ' VAL . . . . . 0.744 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.3 125.09 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 0.0 111.42 179.865 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.2 mt -110.66 151.81 43.05 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.389 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -63.26 -23.49 72.39 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.293 1.995 . . . . 0.0 112.293 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.78 -5.5 53.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.552 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -110.15 -36.69 5.77 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.9 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 389' ' ' LEU . . . . . 0.481 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.99 34.9 0.46 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.997 0.427 . . . . 0.0 110.616 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.52 -15.81 5.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.652 -179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -98.31 148.83 23.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.565 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -73.63 -30.16 62.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.201 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -75.42 -47.59 26.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.001 0.429 . . . . 0.0 110.765 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.56 -44.33 91.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.748 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.27 -59.43 4.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.245 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.06 -27.31 61.59 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.185 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -40.99 67.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.405 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 398' ' ' ILE . . . . . 0.495 HD13 HG12 ' B' ' 384' ' ' VAL . 65.1 mt -74.88 -53.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.505 -179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 399' ' ' VAL . . . . . 0.621 HG22 HD12 ' B' ' 417' ' ' ILE . 59.6 t -53.31 -46.98 57.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.775 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -64.46 -59.94 3.75 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.756 0.312 . . . . 0.0 111.548 -179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.65 -57.25 11.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.288 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.6 t -52.04 -32.9 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.391 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 403' ' ' ARG . . . . . 0.446 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.21 -57.31 4.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.824 0.345 . . . . 0.0 111.214 -179.989 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.95 -33.64 64.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.122 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 405' ' ' GLU . . . . . 0.55 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.53 -47.05 43.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.919 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.87 -23.97 67.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.148 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.07 30.41 1.09 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.981 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.15 -17.11 12.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.873 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -106.7 -15.48 14.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.535 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.37 4.12 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.627 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 411' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.26 132.51 56.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.612 0.244 . . . . 0.0 111.083 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 412' ' ' VAL . . . . . 0.422 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.51 115.47 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.101 0.477 . . . . 0.0 110.532 179.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . 0.7 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.8 mttt -56.6 -61.93 2.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.239 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.9 p -153.05 -169.38 3.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.171 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 415' ' ' ILE . . . . . 0.614 HG23 HG12 ' B' ' 434' ' ' VAL . 48.5 mt -145.12 128.96 12.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.848 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 416' ' ' GLU . . . . . 0.421 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.91 108.77 18.66 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.68 179.792 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 417' ' ' ILE . . . . . 1.006 HG23 HG21 ' B' ' 432' ' ' ILE . 60.7 mt -128.51 108.63 19.09 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.663 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 418' ' ' PRO . . . . . 0.637 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.61 147.7 9.2 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.587 2.191 . . . . 0.0 112.919 -179.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.92 74.67 21.85 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.13 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -47.08 117.11 2.02 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.752 2.302 . . . . 0.0 112.407 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 421' ' ' VAL . . . . . 0.602 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.6 t -74.43 97.84 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.942 0.401 . . . . 0.0 111.2 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.51 21.85 9.01 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.49 0.662 . . . . 0.0 109.321 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 423' ' ' GLY . . . . . 0.649 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.28 29.26 6.09 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-N 114.755 -1.111 . . . . 0.0 111.346 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 424' ' ' VAL . . . . . 0.602 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.41 -37.6 31.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.84 35.86 4.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.817 0.342 . . . . 0.0 111.805 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 426' ' ' VAL . . . . . 0.671 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.37 -44.72 47.55 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.755 179.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 427' ' ' PRO . . . . . 0.671 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.24 77.11 0.33 Allowed 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.5 2.134 . . . . 0.0 111.053 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.31 -15.42 3.21 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.358 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.9 t -67.64 149.39 50.12 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.519 0.199 . . . . 0.0 110.766 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.51 -14.14 5.07 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.854 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.45 126.07 44.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.774 0.321 . . . . 0.0 111.072 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 432' ' ' ILE . . . . . 1.006 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.02 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.258 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 433' ' ' PHE . . . . . 0.605 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.45 -176.38 2.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.032 0.444 . . . . 0.0 111.926 -178.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 434' ' ' VAL . . . . . 0.614 HG12 HG23 ' B' ' 415' ' ' ILE . 3.2 m -135.84 141.69 41.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.207 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 435' ' ' GLU . . . . . 0.491 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.38 108.63 17.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.833 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.82 168.41 12.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.239 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 437' ' ' THR . . . . . 0.7 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.1 p -94.93 -45.39 7.29 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.519 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.84 146.66 52.25 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.057 0.456 . . . . 0.0 111.216 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.26 -12.75 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.212 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.64 -54.86 25.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.156 0.503 . . . . 0.0 110.132 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -75.1 -29.44 60.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.859 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.23 -31.72 72.3 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.22 179.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.64 -48.07 15.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.63 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.63 -12.04 59.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.762 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -56.03 3.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.914 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 446' ' ' MET . . . . . 0.586 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.6 OUTLIER -62.88 -28.07 69.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.464 179.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.67 -16.18 63.31 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.598 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.65 -8.59 22.51 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.408 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 449' ' ' LEU . . . . . 0.401 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.73 -19.7 19.47 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.764 0.316 . . . . 0.0 110.915 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 4.4 t -76.78 129.32 36.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.131 0.491 . . . . 0.0 110.956 179.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 97.08 -10.22 65.69 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.994 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 452' ' ' ARG . . . . . 0.424 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -76.09 -152.2 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 117.081 0.44 . . . . 0.0 110.492 178.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 453' ' ' LYS . . . . . 0.467 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.84 117.06 2.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.859 0.361 . . . . 0.0 111.306 -179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.17 -36.38 75.2 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.537 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.28 -50.96 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.788 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 456' ' ' ASN . . . . . 0.571 ' HB3' ' HG2' ' A' ' 27' ' ' MET . 6.4 p30 -157.17 24.94 0.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.704 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 457' ' ' ARG . . . . . 0.442 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.57 135.4 18.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.244 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 14.7 p -59.86 139.06 19.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.666 177.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 459' ' ' VAL . . . . . 0.694 HG12 ' HB3' ' B' ' 383' ' ' MET . 14.7 m -102.18 125.85 56.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.258 0.551 . . . . 0.0 111.843 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 460' ' ' VAL . . . . . 0.599 HG21 HG23 ' A' ' 53' ' ' ILE . 77.7 t -91.65 103.01 14.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.058 175.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 35.7 p -106.77 113.12 26.42 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.053 -177.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 462' ' ' LYS . . . . . 0.913 ' HD3' ' HB ' ' A' ' 40' ' ' ILE . 5.5 pttm -121.28 -157.33 0.72 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.343 0.592 . . . . 0.0 111.727 -178.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 463' ' ' TYR . . . . . 0.408 ' H ' ' HB2' ' B' ' 462' ' ' LYS . 1.3 m-85 -114.88 146.97 40.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.581 -172.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 464' ' ' CYS . . . . . 0.564 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.86 149.07 47.47 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.131 0.491 . . . . 0.0 111.284 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 465' ' ' ASP . . . . . 0.452 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.44 129.36 66.41 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.351 -179.857 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 466' ' ' PRO . . . . . 0.49 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.3 Cg_endo -54.05 -33.32 72.96 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.763 2.309 . . . . 0.0 112.12 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.94 -58.52 7.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.445 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.41 -33.82 68.26 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.282 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 469' ' ' TYR . . . . . 0.491 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -59.96 -51.28 70.35 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.177 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.4 m80 -53.31 -47.55 69.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.358 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 471' ' ' ARG . . . . . 0.456 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.69 -2.15 49.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.383 -179.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.09 20.84 8.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.917 0.389 . . . . 0.0 110.247 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 473' ' ' ASP . . . . . 0.456 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.78 -20.67 23.63 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.94 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.29 29.17 6.22 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.294 -178.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 59.0 m95 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.16 -0.924 . . . . 0.0 111.446 -179.214 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.0 mtp . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.766 0.317 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.55 124.07 31.7 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.092 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.9 t -123.38 139.31 54.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.053 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 141.02 -90.66 0.18 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.573 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -117.85 170.12 9.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.699 0.285 . . . . 0.0 111.015 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.443 ' HB3' ' H ' ' A' ' 7' ' ' ALA . 21.7 t-20 -100.28 -89.87 0.33 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.814 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.443 ' H ' ' HB3' ' A' ' 6' ' ' ASN . . . -156.7 51.47 0.5 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.051 0.453 . . . . 0.0 110.679 179.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.486 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.1 t -83.89 134.66 43.73 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.474 -179.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 17.1 Cg_exo -68.13 139.35 46.23 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.936 2.424 . . . . 0.0 112.218 176.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.457 ' H ' ' HG ' ' A' ' 10' ' ' LEU . 0.7 OUTLIER -83.5 161.63 21.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.094 0.474 . . . . 0.0 111.315 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -117.89 110.94 18.36 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.879 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.477 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 15.0 m-85 -81.88 131.98 55.57 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.469 176.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 39.1 Cg_exo -56.54 115.53 2.54 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 123.287 2.658 . . . . 0.0 112.354 -173.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.01 -166.75 1.32 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.85 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.38 51.93 12.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.41 -36.23 3.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.974 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.77 91.84 2.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.92 -54.2 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.783 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.83 111.22 13.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.03 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.57 24.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.739 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.55 12.79 19.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.995 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.545 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.7 m95 -142.05 53.05 1.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.994 0.426 . . . . 0.0 110.83 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.2 -156.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.885 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.462 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.35 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.883 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.83 124.67 52.34 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-O 118.93 -0.557 . . . . 0.0 110.57 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.534 HG21 ' HB2' ' A' ' 29' ' ' GLN . 0.2 OUTLIER -143.6 -176.27 4.89 Favored 'General case' 0 C--N 1.328 -0.364 0 O-C-N 123.872 0.732 . . . . 0.0 110.041 172.802 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.532 ' H ' HG22 ' A' ' 26' ' ' THR . 4.6 mpp? -110.28 -38.41 5.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.775 0.321 . . . . 0.0 110.742 177.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -108.9 -22.33 12.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.709 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.534 ' HB2' HG21 ' A' ' 26' ' ' THR . 11.8 mm100 -114.58 41.48 2.33 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.319 -178.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.513 ' HB2' ' H ' ' A' ' 26' ' ' THR . 81.0 tttt -129.76 138.07 50.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.819 0.343 . . . . 0.0 111.022 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.452 ' H ' ' HZ1' ' B' ' 453' ' ' LYS . 29.4 p -126.02 -58.56 1.37 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.882 176.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.538 ' HA ' HH22 ' A' ' 63' ' ' ARG . 13.9 m -112.49 144.35 20.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.087 0.47 . . . . 0.0 111.87 -177.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.433 ' H ' HH22 ' A' ' 63' ' ' ARG . 1.0 OUTLIER -79.94 154.34 75.31 Favored Pre-proline 0 CA--C 1.53 0.176 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.861 177.325 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.11 155.77 60.77 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.732 2.288 . . . . 0.0 113.126 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.74 16.9 2.39 Favored Glycine 0 N--CA 1.452 -0.293 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.627 178.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -128.11 121.82 21.88 Favored Pre-proline 0 C--O 1.233 0.211 0 CA-C-O 120.658 0.266 . . . . 0.0 111.281 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -73.65 147.25 39.98 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.864 2.376 . . . . 0.0 111.978 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.693 ' HB ' HG13 ' B' ' 460' ' ' VAL . 55.4 p -138.14 90.84 2.51 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-O 121.138 0.494 . . . . 0.0 111.32 -175.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.1 m -142.71 133.23 23.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.714 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.855 ' H ' ' HB3' ' B' ' 462' ' ' LYS . 0.4 OUTLIER -93.98 135.56 24.61 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.533 179.164 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 40' ' ' ILE . 13.6 Cg_exo -70.62 169.11 20.78 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 123.539 2.826 . . . . 0.0 113.117 -177.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -78.27 121.12 5.14 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.649 2.233 . . . . 0.0 113.222 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 109.36 38.95 1.71 Allowed Glycine 0 C--N 1.33 0.218 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.74 176.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.493 ' HB3' ' HG3' ' A' ' 49' ' ' GLU . 3.8 mm? -113.58 129.54 56.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.769 0.318 . . . . 0.0 111.077 -173.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 54.7 p -79.19 159.07 27.53 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 174.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.506 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.11 -31.32 71.01 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 120.878 0.37 . . . . 0.0 111.305 -175.025 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -72.27 -45.12 61.48 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.3 -33.28 72.93 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.695 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.571 ' HG2' HG12 ' A' ' 40' ' ' ILE . 35.6 mt-10 -60.56 -45.21 94.75 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.145 177.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.556 ' O ' HG22 ' A' ' 54' ' ' VAL . 16.0 mmt180 -62.81 -43.32 99.11 Favored 'General case' 0 C--O 1.185 -2.327 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.211 177.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.541 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.42 -41.44 85.03 Favored 'General case' 0 C--N 1.32 -0.699 0 O-C-N 123.78 0.675 . . . . 0.0 111.632 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -65.3 -44.76 86.88 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.842 177.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.689 ' O ' ' HG ' ' A' ' 56' ' ' LEU . 92.2 mt -69.18 -44.83 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.309 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 50' ' ' ARG . 35.1 m -67.05 -35.49 74.66 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.71 0 CA-C-O 118.656 -0.688 . . . . 0.0 111.873 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.18 -44.77 92.17 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 118.595 0.634 . . . . 0.0 110.335 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 53' ' ' ILE . 3.3 pp -72.12 -23.17 61.28 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.125 -178.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.425 ' NE2' HD21 ' B' ' 382' ' ' ASN . 48.1 mt-30 -85.86 -30.67 22.73 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.199 175.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.469 HD13 HD13 ' A' ' 113' ' ' ILE . 73.2 mt -62.59 -47.01 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.07 0.548 . . . . 0.0 110.411 172.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.483 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.34 -41.72 84.75 Favored 'General case' 0 CA--C 1.512 -0.482 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.667 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -68.53 -32.82 73.04 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.37 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.538 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -67.37 -45.1 77.27 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 173.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 23.8 m -65.47 -35.76 81.87 Favored 'General case' 0 N--CA 1.433 -1.288 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.538 HH22 ' HA ' ' A' ' 32' ' ' VAL . 39.2 ttp180 -55.73 -42.82 75.92 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.0 ttmt -61.83 -47.68 84.01 Favored 'General case' 0 N--CA 1.432 -1.361 0 CA-C-N 113.798 -1.546 . . . . 0.0 111.913 179.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.21 -28.86 63.45 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 119.758 -0.777 . . . . 0.0 111.888 176.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -67.92 -47.25 69.27 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.499 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.11 -17.51 14.46 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 119.926 -0.709 . . . . 0.0 112.904 -177.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.75 29.49 10.67 Favored Glycine 0 C--N 1.316 -0.528 0 C-N-CA 119.887 -1.149 . . . . 0.0 111.307 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.42 93.16 7.16 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.244 0.545 . . . . 0.0 110.261 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 23.3 tp -112.82 -39.42 4.28 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.68 178.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -151.19 -113.42 0.59 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.59 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 29.2 pt -85.74 153.95 58.35 Favored Pre-proline 0 CA--C 1.53 0.192 0 CA-C-O 120.796 0.331 . . . . 0.0 111.538 -178.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.419 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 55.2 Cg_endo -70.77 156.02 61.5 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.864 2.376 . . . . 0.0 112.368 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 73' ' ' PRO . 31.9 Cg_exo -60.13 133.06 47.7 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.935 2.423 . . . . 0.0 112.837 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.427 ' HA ' ' HD3' ' A' ' 76' ' ' PRO . 16.0 m120 -91.33 141.39 26.08 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.987 -179.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 75' ' ' ASN . 6.0 Cg_exo -80.42 76.59 4.45 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.3 2.667 . . . . 0.0 112.46 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -160.53 -60.12 0.06 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.567 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -121.15 121.38 37.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.699 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -106.03 -63.23 1.28 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.424 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.467 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 67.1 m -128.5 109.87 19.19 Favored Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.82 179.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 80' ' ' SER . 2.7 Cg_exo -76.6 149.62 30.6 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.334 2.689 . . . . 0.0 112.645 -178.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 45.7 t -136.5 120.33 12.4 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.797 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -68.94 163.79 36.17 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.98 2.454 . . . . 0.0 112.684 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.752 ' HB3' ' HD3' ' A' ' 85' ' ' PRO . 38.9 tt0 -69.03 -54.34 12.32 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.549 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.752 ' HD3' ' HB3' ' A' ' 84' ' ' GLU . 9.8 Cg_exo -72.6 173.81 12.7 Favored 'Trans proline' 0 C--N 1.361 1.201 0 C-N-CA 122.369 2.046 . . . . 0.0 112.256 177.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 17.8 tt -78.44 137.05 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.091 0.472 . . . . 0.0 110.966 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -75.64 133.84 40.76 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.724 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -80.22 133.82 36.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.015 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 35.0 t -74.55 -45.76 43.45 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.781 178.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 63.72 -91.27 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.97 0.794 . . . . 0.0 111.505 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -172.57 38.25 0.15 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.434 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -86.34 -59.65 2.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.335 0.112 . . . . 0.0 110.862 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 33.1 ttm180 71.91 -76.36 0.07 Allowed 'General case' 0 N--CA 1.469 0.504 0 O-C-N 124.152 0.907 . . . . 0.0 112.351 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 88.3 mt -91.92 -162.86 0.97 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 120.888 0.375 . . . . 0.0 111.758 -176.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -74.88 147.53 40.97 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.349 0.595 . . . . 0.0 112.191 -176.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -140.22 -50.02 0.47 Allowed 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.737 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.19 -52.56 15.98 Favored 'General case' 0 C--N 1.305 -1.365 0 O-C-N 121.273 -0.892 . . . . 0.0 109.598 -178.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.447 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.6 mp0 -53.27 -51.75 61.27 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-N 113.616 -1.629 . . . . 0.0 110.614 -178.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.77 -38.61 86.92 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 113.482 -1.69 . . . . 0.0 110.626 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.53 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.4 ttp180 -59.92 -44.6 94.21 Favored 'General case' 0 CA--C 1.51 -0.563 0 O-C-N 123.182 0.302 . . . . 0.0 110.38 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.719 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.6 m -68.95 -50.03 52.8 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.679 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.455 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.37 -41.32 93.91 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 -175.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.97 -39.24 90.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.595 0.236 . . . . 0.0 110.373 178.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.534 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.17 -40.19 89.07 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.2 mt -63.89 -41.08 97.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.7 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.06 -34.32 78.13 Favored 'General case' 0 C--O 1.211 -0.955 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.734 178.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.39 74.31 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 177.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.46 -48.8 76.21 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 175.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.552 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.23 -45.59 93.92 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.405 179.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.26 -37.41 85.35 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 123.579 0.751 . . . . 0.0 111.019 -178.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.79 -43.81 85.85 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 177.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.5 mt -72.17 -38.67 69.07 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.157 -0.928 . . . . 0.0 110.75 177.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.35 -50.88 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 N-CA-C 110.488 -0.19 . . . . 0.0 110.488 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 96.0 m -60.79 -39.44 88.9 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.272 0.558 . . . . 0.0 110.589 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.614 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.88 -49.55 61.39 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.063 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.4 -37.11 84.51 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -177.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.1 t -65.57 -36.81 78.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.63 -40.78 80.17 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.206 0.527 . . . . 0.0 110.231 177.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.2 mt -71.4 -40.65 70.39 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.019 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.403 ' HA ' ' HD2' ' A' ' 121' ' ' PRO . 45.4 t30 -133.57 111.22 12.54 Favored Pre-proline 0 C--N 1.317 -0.834 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 120' ' ' ASN . 59.9 Cg_endo -68.79 -22.66 36.55 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.765 2.31 . . . . 0.0 112.531 -178.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.24 0.06 55.95 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.353 0.596 . . . . 0.0 111.175 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.91 134.64 54.42 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.61 -178.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.43 109.21 62.95 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.251 177.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.26 157.89 59.86 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.305 2.004 . . . . 0.0 111.516 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.57 154.5 24.88 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 123.603 2.869 . . . . 0.0 111.809 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.16 -28.59 67.42 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 -173.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -71.61 -12.36 61.31 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -164.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -138.42 115.31 10.79 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.187 176.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -94.5 129.11 37.65 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.254 178.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.518 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 34.5 Cg_exo -59.57 139.05 87.25 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.897 2.398 . . . . 0.0 112.583 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.518 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 16.4 Cg_exo -68.73 -10.63 29.65 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.271 2.647 . . . . 0.0 112.793 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -79.65 -15.3 57.84 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.987 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 15.5 m -84.8 105.06 15.3 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -95.51 110.33 22.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.164 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 2.9 m -104.01 117.54 49.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.07 178.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 42.9 t -114.85 145.91 41.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.833 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -131.82 150.22 52.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.035 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -106.43 85.33 2.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.324 177.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 12.0 p -89.97 138.29 19.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.212 -177.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 47.2 ttm -97.12 133.86 41.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.5 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.496 HG13 ' HD2' ' A' ' 143' ' ' PRO . 8.8 tt -79.6 130.42 67.98 Favored Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.821 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.496 ' HD2' HG13 ' A' ' 142' ' ' ILE . 18.9 Cg_endo -60.67 143.58 99.43 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.93 2.42 . . . . 0.0 112.871 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -84.78 156.13 21.52 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.035 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 . . . . . 0 C--O 1.251 1.147 0 CA-C-O 118.45 -0.786 . . . . 0.0 111.503 -179.853 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.156 0 N-CA-C 112.417 -0.273 . . . . 0.0 112.417 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 65.42 103.69 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.497 0 C-N-CA 123.15 0.58 . . . . 0.0 111.73 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -83.8 155.22 13.49 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.911 2.407 . . . . 0.0 112.363 176.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 375' ' ' THR . . . . . 0.456 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -127.5 -71.23 0.67 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.123 175.253 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 376' ' ' GLU . . . . . 0.481 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.85 -45.98 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 377' ' ' VAL . . . . . 0.558 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.68 150.99 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.123 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.465 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 378' ' ' LEU . . . . . 0.594 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.61 152.51 20.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.233 -179.057 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 379' ' ' CYS . . . . . 0.613 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.55 142.59 46.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.629 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.522 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.76 101.72 5.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.91 0.385 . . . . 0.0 110.958 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 381' ' ' MET . . . . . . . . . . . . . 85.3 mtp -119.12 166.43 12.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.97 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 382' ' ' ASN . . . . . 0.425 HD21 ' NE2' ' A' ' 57' ' ' GLN . 13.3 t30 58.7 51.26 7.88 Favored 'General case' 0 C--O 1.232 0.133 0 O-C-N 123.821 0.7 . . . . 0.0 111.345 -178.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 383' ' ' MET . . . . . 0.441 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.88 14.41 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.237 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 384' ' ' VAL . . . . . 0.739 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.3 125.01 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.382 179.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.413 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.61 151.78 43.01 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.468 179.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.2 -23.4 72.77 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.323 2.015 . . . . 0.0 112.279 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.9 -5.53 53.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.526 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.13 -36.71 5.77 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.848 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 389' ' ' LEU . . . . . 0.486 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.99 34.95 0.46 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.008 0.432 . . . . 0.0 110.669 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 390' ' ' LEU . . . . . 0.549 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.53 -15.72 5.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.693 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -98.34 148.77 23.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.553 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -73.55 -30.29 62.97 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.203 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -75.38 -47.58 26.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.768 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.63 -44.21 91.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.802 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -56.37 -59.47 4.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.193 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -27.32 61.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.234 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.17 -40.99 67.56 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.471 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 398' ' ' ILE . . . . . 0.489 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.91 -53.61 16.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.539 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 399' ' ' VAL . . . . . 0.613 HG22 HD12 ' B' ' 417' ' ' ILE . 59.3 t -53.4 -46.84 58.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.801 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.51 -59.94 3.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.52 -179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.68 -57.08 12.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.441 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.14 -32.86 16.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.346 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 403' ' ' ARG . . . . . 0.451 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.22 -57.42 4.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.766 0.317 . . . . 0.0 111.113 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -55.96 -33.68 64.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.127 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 405' ' ' GLU . . . . . 0.545 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 22.0 mm-40 -73.39 -47.02 45.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.981 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.1 m -63.85 -23.98 67.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.187 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.14 30.37 1.11 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.932 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.09 -17.12 12.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.69 -15.45 14.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.493 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.17 -139.4 4.14 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.61 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 411' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.25 132.47 56.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.677 0.275 . . . . 0.0 111.07 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 412' ' ' VAL . . . . . 0.425 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.4 p -117.43 115.45 48.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 121.02 0.438 . . . . 0.0 110.653 179.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . 0.697 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.62 -61.97 2.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.177 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.7 p -153.07 -169.44 3.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.049 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 415' ' ' ILE . . . . . 0.615 HG23 HG12 ' B' ' 434' ' ' VAL . 48.4 mt -145.0 128.89 12.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.945 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 416' ' ' GLU . . . . . 0.419 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.84 108.79 18.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.889 0.376 . . . . 0.0 110.702 179.811 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 417' ' ' ILE . . . . . 0.966 HG23 HG21 ' B' ' 432' ' ' ILE . 60.4 mt -128.49 108.59 19.11 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.675 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 418' ' ' PRO . . . . . 0.643 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.54 147.62 9.1 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 122.669 2.246 . . . . 0.0 112.855 -179.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 419' ' ' ARG . . . . . 0.549 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.87 74.64 22.05 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.107 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.16 117.07 2.02 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.732 2.288 . . . . 0.0 112.477 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 421' ' ' VAL . . . . . 0.597 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.6 t -74.39 97.82 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.178 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.62 21.77 9.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.535 0.684 . . . . 0.0 109.298 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 423' ' ' GLY . . . . . 0.644 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.23 29.25 6.11 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.377 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 424' ' ' VAL . . . . . 0.597 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.45 -37.47 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.9 35.81 4.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.745 0.307 . . . . 0.0 111.745 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 426' ' ' VAL . . . . . 0.666 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.31 -44.69 48.1 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.792 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 427' ' ' PRO . . . . . 0.666 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.9 Cg_endo -66.25 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.491 2.128 . . . . 0.0 111.088 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.26 -15.44 3.22 Favored Glycine 0 N--CA 1.447 -0.604 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.344 -178.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.58 149.38 50.18 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.68 0.276 . . . . 0.0 110.771 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.52 -14.13 5.06 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.845 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 431' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -125.42 126.11 44.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.836 0.351 . . . . 0.0 111.108 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 432' ' ' ILE . . . . . 0.966 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -131.06 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.231 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 433' ' ' PHE . . . . . 0.613 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.47 -176.36 2.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.982 0.42 . . . . 0.0 111.939 -178.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 434' ' ' VAL . . . . . 0.615 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.87 141.75 41.02 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.145 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 435' ' ' GLU . . . . . 0.483 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.36 108.5 17.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.845 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.76 168.29 12.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.251 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 437' ' ' THR . . . . . 0.697 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.0 p -94.86 -45.42 7.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.517 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.89 146.57 52.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.99 0.424 . . . . 0.0 111.25 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.19 -12.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.236 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -54.86 25.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.149 0.5 . . . . 0.0 110.043 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -75.13 -29.5 60.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.829 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.12 -31.86 72.37 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.19 179.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.61 -48.01 15.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.641 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.63 -12.02 59.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.738 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.84 -55.73 3.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.902 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 446' ' ' MET . . . . . 0.594 ' HB3' HD21 ' B' ' 378' ' ' LEU . 0.3 OUTLIER -63.69 -27.46 69.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.25 -179.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.87 -16.33 63.23 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.574 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.6 -8.64 22.53 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.425 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 449' ' ' LEU . . . . . . . . . . . . . 97.2 mt -95.61 -19.52 19.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.784 0.326 . . . . 0.0 111.004 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 450' ' ' THR . . . . . . . . . . . . . 1.7 t -72.37 132.28 43.74 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.894 176.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 92.45 -9.55 75.78 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.299 178.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 452' ' ' ARG . . . . . 0.422 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.07 -152.25 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 117.313 0.556 . . . . 0.0 110.525 178.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 453' ' ' LYS . . . . . 0.462 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.8 117.1 2.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.884 0.373 . . . . 0.0 111.331 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.27 -36.32 75.33 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.549 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.833 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 456' ' ' ASN . . . . . 0.437 ' HB3' ' NE2' ' A' ' 29' ' ' GLN . 6.4 p30 -157.19 24.91 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.731 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 457' ' ' ARG . . . . . 0.441 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.48 135.73 19.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.301 179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 14.8 p -60.83 137.28 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.968 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 459' ' ' VAL . . . . . 0.402 HG12 HG23 ' B' ' 461' ' ' THR . 45.0 t -99.77 115.36 40.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.414 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 460' ' ' VAL . . . . . 0.693 HG13 ' HB ' ' A' ' 38' ' ' THR . 39.7 t -84.88 102.76 11.3 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.959 176.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 461' ' ' THR . . . . . 0.402 HG23 HG12 ' B' ' 459' ' ' VAL . 21.4 p -102.68 123.13 45.8 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.377 -177.189 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 462' ' ' LYS . . . . . 0.855 ' HB3' ' H ' ' A' ' 40' ' ' ILE . 0.0 OUTLIER -130.56 -159.38 0.96 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.279 0.562 . . . . 0.0 111.758 -179.485 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -114.7 147.0 40.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.667 -171.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 464' ' ' CYS . . . . . 0.558 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.9 148.98 47.36 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.068 0.461 . . . . 0.0 111.382 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 465' ' ' ASP . . . . . 0.456 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.36 129.37 66.64 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.378 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 466' ' ' PRO . . . . . 0.481 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.1 -33.24 73.14 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.677 2.251 . . . . 0.0 112.07 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -58.46 7.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.43 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.82 68.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.281 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 469' ' ' TYR . . . . . 0.483 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.03 -51.25 70.45 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.156 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -53.32 -47.52 69.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.4 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 471' ' ' ARG . . . . . 0.456 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.75 -2.06 49.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.415 -179.895 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.1 20.8 8.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.876 0.37 . . . . 0.0 110.236 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 473' ' ' ASP . . . . . 0.456 ' HB2' ' HD3' ' B' ' 471' ' ' ARG . 0.3 OUTLIER -56.83 -19.85 19.58 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.927 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 474' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 66.55 24.05 10.3 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.014 0.526 . . . . 0.0 112.043 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.469 -0.776 . . . . 0.0 110.814 -179.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.1 mtt . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 120.992 0.425 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.95 -22.84 17.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.807 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.0 m -113.39 99.71 7.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.828 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -145.21 -72.74 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.979 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 63.24 -91.62 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 176.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -74.26 -72.26 0.29 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.722 0.296 . . . . 0.0 111.52 -176.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.72 166.35 10.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.012 0.434 . . . . 0.0 111.578 -177.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.442 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.6 t -85.38 137.99 36.51 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.149 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 32.8 Cg_exo -59.12 137.11 77.34 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.967 2.445 . . . . 0.0 112.226 178.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.461 ' HA ' HD23 ' A' ' 10' ' ' LEU . 12.1 mt -72.96 103.41 3.75 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.237 0.542 . . . . 0.0 111.588 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -147.19 0.44 0.71 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.652 176.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -99.35 139.55 21.01 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.807 -178.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_exo -56.65 115.65 2.63 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 123.04 2.493 . . . . 0.0 112.205 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.0 -166.77 1.33 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.903 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.39 51.91 12.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.908 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.36 -36.18 3.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.05 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.84 91.91 2.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.87 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.89 -54.27 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.796 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -127.82 111.19 13.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.941 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.97 125.61 24.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.726 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.67 12.83 19.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.94 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.558 ' HE1' ' HG3' ' B' ' 405' ' ' GLU . 71.7 m95 -142.02 53.07 1.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.773 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.25 -156.56 0.13 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.467 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.31 -37.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.857 179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.64 119.65 37.48 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.518 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.64 HG22 ' H ' ' A' ' 27' ' ' MET . 0.2 OUTLIER 65.2 -166.6 0.22 Allowed 'General case' 0 CA--C 1.538 0.51 0 O-C-N 123.982 0.802 . . . . 0.0 109.854 -171.353 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.64 ' H ' HG22 ' A' ' 26' ' ' THR . 3.1 tpt -86.55 -24.29 25.52 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.673 0.273 . . . . 0.0 110.4 177.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -141.59 143.61 33.79 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.951 0.405 . . . . 0.0 111.147 178.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.466 ' HG3' ' H ' ' A' ' 31' ' ' THR . 5.8 tp-100 -157.88 153.79 26.88 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.378 -178.094 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -94.89 -27.72 15.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.197 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.466 ' H ' ' HG3' ' A' ' 29' ' ' GLN . 7.3 m -105.15 104.9 14.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.909 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.4 m -119.18 138.45 49.85 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-O 121.008 0.433 . . . . 0.0 111.657 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.436 HG22 HE22 ' A' ' 24' ' ' GLN . 0.0 OUTLIER -144.54 126.5 8.11 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.083 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.95 131.61 13.38 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.606 2.204 . . . . 0.0 111.935 175.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -129.97 -94.13 0.7 Allowed Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.186 -1.006 . . . . 0.0 113.639 -175.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.493 ' HB2' HD13 ' A' ' 56' ' ' LEU . 21.7 mmt -71.81 138.79 82.75 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-O 120.878 0.371 . . . . 0.0 111.734 -174.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.55 ' HA ' ' HB ' ' B' ' 450' ' ' THR . 74.2 Cg_endo -79.17 155.34 25.64 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.991 2.461 . . . . 0.0 112.995 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.515 ' HB ' HD11 ' A' ' 53' ' ' ILE . 72.0 p -125.2 15.27 8.4 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.858 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.3 m -63.67 121.62 12.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-O 121.091 0.472 . . . . 0.0 111.472 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.845 ' H ' ' HG2' ' B' ' 462' ' ' LYS . 67.0 mt -111.92 121.37 39.8 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.245 -177.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.463 ' O ' HD23 ' A' ' 44' ' ' LEU . 48.9 Cg_endo -68.9 167.21 23.93 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 123.462 2.775 . . . . 0.0 113.23 -177.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.8 118.34 5.53 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.608 2.205 . . . . 0.0 113.156 178.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 124.63 41.74 0.37 Allowed Glycine 0 C--N 1.332 0.306 0 C-N-CA 121.072 -0.585 . . . . 0.0 112.342 175.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.463 HD23 ' O ' ' A' ' 41' ' ' PRO . 3.2 mm? -124.65 145.1 49.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.015 0.436 . . . . 0.0 111.659 -175.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.502 ' HB ' ' OE1' ' A' ' 47' ' ' GLU . 16.1 p -89.75 158.0 17.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.163 174.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.513 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.78 -31.43 71.63 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 120.956 0.407 . . . . 0.0 111.317 -176.107 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.502 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.27 -45.22 61.05 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -69.14 -33.03 72.8 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.796 -177.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.551 ' HG2' HG21 ' A' ' 40' ' ' ILE . 39.9 mt-10 -62.2 -42.91 99.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.419 178.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.555 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -64.03 -43.36 95.8 Favored 'General case' 0 C--O 1.185 -2.302 0 CA-C-O 118.803 -0.618 . . . . 0.0 110.274 176.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.56 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.35 -41.87 85.66 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 123.792 0.683 . . . . 0.0 111.583 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -65.73 -43.19 89.79 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.744 0.307 . . . . 0.0 110.999 176.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.779 ' HA ' HD23 ' A' ' 56' ' ' LEU . 1.0 OUTLIER -73.22 -38.49 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.465 -178.708 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 51' ' ' ALA . 35.1 m -70.34 -35.52 62.93 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.788 0 CA-C-O 118.662 -0.685 . . . . 0.0 111.881 177.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.13 -43.89 92.02 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.591 0.632 . . . . 0.0 110.275 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.779 HD23 ' HA ' ' A' ' 53' ' ' ILE . 0.6 OUTLIER -65.24 -34.11 77.58 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.946 178.069 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.424 ' N ' ' HG ' ' A' ' 56' ' ' LEU . 48.8 tt0 -80.87 -29.23 35.77 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.467 HD13 HD13 ' A' ' 113' ' ' ILE . 73.0 mt -65.08 -47.06 89.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.348 174.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -67.4 -41.93 84.11 Favored 'General case' 0 CA--C 1.513 -0.45 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.697 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -58.84 -43.78 90.79 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 124.887 1.367 . . . . 0.0 110.843 176.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.527 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.8 mt -66.01 -44.94 83.31 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.401 178.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.0 m -65.56 -35.7 81.62 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.503 ' O ' HG22 ' A' ' 67' ' ' THR . 39.3 ttp180 -55.89 -42.68 76.34 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 122.069 0.937 . . . . 0.0 108.509 176.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.527 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.84 -47.78 83.53 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.836 -1.529 . . . . 0.0 111.883 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.412 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.16 -28.91 63.54 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 119.754 -0.778 . . . . 0.0 111.791 177.069 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -68.02 -47.1 69.38 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.503 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.11 -17.59 14.43 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 120.002 -0.679 . . . . 0.0 112.821 -177.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.8 29.44 10.66 Favored Glycine 0 C--N 1.315 -0.631 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.252 -177.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.27 92.56 6.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.174 0.511 . . . . 0.0 110.268 -179.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.437 HD11 HD21 ' A' ' 105' ' ' LEU . 3.0 mm? -113.27 29.3 8.09 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 114.009 -1.45 . . . . 0.0 109.884 175.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 120.68 -61.29 0.52 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.877 178.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 13.0 pt -116.07 158.36 42.76 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 120.837 0.351 . . . . 0.0 111.742 -176.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.41 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 15.6 Cg_exo -69.48 160.02 51.37 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 123.195 2.597 . . . . 0.0 112.196 176.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 73' ' ' PRO . 23.8 Cg_exo -64.48 131.61 30.45 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.944 2.429 . . . . 0.0 112.325 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -116.57 102.9 53.17 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.086 -179.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -83.73 -160.9 0.13 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.254 2.636 . . . . 0.0 112.375 177.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 63.12 92.07 0.07 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.565 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -118.12 142.47 47.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.038 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.412 ' O ' ' HD3' ' A' ' 81' ' ' PRO . 29.7 ttt180 -79.06 -65.9 0.94 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.534 -178.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.2 m -103.79 103.25 35.82 Favored Pre-proline 0 C--O 1.232 0.173 0 CA-C-O 120.747 0.308 . . . . 0.0 111.221 -176.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 79' ' ' ARG . 5.4 Cg_exo -79.89 139.31 13.72 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.096 2.531 . . . . 0.0 112.423 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 48.9 m -90.0 141.07 27.72 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.576 178.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.86 114.26 2.0 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.92 2.413 . . . . 0.0 112.474 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.86 160.73 35.67 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.878 -177.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.16 149.15 82.2 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.677 2.251 . . . . 0.0 112.294 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 19.8 pt -72.25 144.01 13.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.596 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -97.99 117.63 32.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.684 176.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -86.24 -174.48 5.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.575 -174.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 75.0 p -73.88 -11.99 60.53 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.642 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -70.96 -35.13 72.04 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.615 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 87.02 71.8 1.29 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.221 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 25.7 tttm -96.55 100.98 12.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.897 0.38 . . . . 0.0 111.11 -177.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -93.46 -14.64 26.47 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.632 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.2 mp -86.73 137.25 32.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.228 176.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -147.46 -83.08 0.12 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.381 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -158.32 -50.16 0.06 Allowed 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -72.15 -52.51 16.31 Favored 'General case' 0 C--N 1.306 -1.323 0 O-C-N 121.237 -0.914 . . . . 0.0 109.604 -178.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.4 mp0 -53.19 -51.77 61.03 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 113.634 -1.621 . . . . 0.0 110.704 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.68 -38.74 87.42 Favored 'General case' 0 N--CA 1.428 -1.533 0 CA-C-N 113.355 -1.748 . . . . 0.0 110.666 -177.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.52 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.93 -44.48 94.32 Favored 'General case' 0 CA--C 1.511 -0.537 0 O-C-N 123.17 0.294 . . . . 0.0 110.384 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.731 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.7 m -68.94 -50.13 51.96 Favored 'General case' 0 N--CA 1.429 -1.521 0 C-N-CA 120.104 -0.638 . . . . 0.0 110.644 178.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.7 mtm180 -65.41 -41.27 93.76 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -175.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -65.9 -39.27 90.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.588 0.232 . . . . 0.0 110.384 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.527 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.2 -40.13 88.99 Favored 'General case' 0 C--O 1.225 -0.235 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.731 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.8 mt -64.04 -40.98 97.51 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.673 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.04 -34.35 78.23 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.785 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.46 -34.4 74.32 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 177.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.5 -48.82 76.04 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 175.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.547 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.21 -45.54 94.16 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 114.505 -1.225 . . . . 0.0 110.396 179.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.26 -37.4 85.33 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.016 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.82 -43.8 86.0 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 177.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 66.1 mt -72.19 -38.64 69.03 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.723 177.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.44 -50.77 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-O 120.474 0.178 . . . . 0.0 110.554 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.8 m -60.79 -39.49 89.04 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.301 0.572 . . . . 0.0 110.544 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.601 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.9 -49.63 60.88 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.015 179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.35 -37.14 84.65 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -177.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 68.7 t -65.54 -36.83 78.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.61 -40.79 80.23 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.23 0.538 . . . . 0.0 110.213 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.5 mt -71.41 -40.69 70.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.006 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -133.57 111.24 12.54 Favored Pre-proline 0 C--N 1.315 -0.894 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.011 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.76 -22.7 36.69 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.836 2.357 . . . . 0.0 112.516 -178.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.29 0.12 55.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.379 0.609 . . . . 0.0 111.203 -177.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -64.86 134.62 54.43 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.66 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -105.4 109.08 62.81 Favored Pre-proline 0 CA--C 1.509 -0.609 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.302 177.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -68.26 157.92 59.72 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.275 1.984 . . . . 0.0 111.503 178.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.58 154.5 24.89 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 123.615 2.877 . . . . 0.0 111.786 177.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -67.93 -30.17 69.41 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -173.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -75.96 -13.21 60.24 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 123.451 0.469 . . . . 0.0 111.748 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -61.3 134.0 56.48 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 121.0 0.429 . . . . 0.0 111.491 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 131' ' ' PRO . 91.0 mttt -106.39 123.13 39.81 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.883 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.478 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 4.0 Cg_exo -77.53 136.0 15.19 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 123.117 2.544 . . . . 0.0 112.311 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 131' ' ' PRO . 7.9 Cg_exo -73.58 137.73 25.66 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 123.048 2.498 . . . . 0.0 112.482 179.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -118.25 116.36 26.62 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.018 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 15.3 t -108.43 3.49 23.3 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.271 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 39.0 mmt180 -80.64 -75.24 0.28 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.224 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 2.4 m -122.38 167.61 15.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.172 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 80.5 m -100.86 -10.77 20.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.095 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -101.68 121.9 42.9 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.96 0.41 . . . . 0.0 111.238 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 96.5 mttt 62.5 -164.6 0.25 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.461 -0.791 . . . . 0.0 112.068 177.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 11.3 p -120.56 150.19 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.177 -177.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 15.4 tpt -92.35 121.09 33.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.572 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 49.7 mm -109.33 119.53 48.09 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.73 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -69.52 139.2 40.48 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.005 2.47 . . . . 0.0 112.485 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -92.35 121.87 34.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.074 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.414 -0.803 . . . . 0.0 110.808 179.176 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.304 0 N-CA-C 112.283 -0.327 . . . . 0.0 112.283 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 43.3 m80 -114.57 93.95 34.64 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 120.733 0.302 . . . . 0.0 110.288 177.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -75.44 136.33 19.39 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.284 2.656 . . . . 0.0 113.846 -174.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 375' ' ' THR . . . . . 0.462 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -115.63 -71.39 0.74 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.143 173.057 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 376' ' ' GLU . . . . . 0.486 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.82 -45.92 0.01 OUTLIER 'General case' 0 CA--C 1.527 0.093 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 377' ' ' VAL . . . . . 0.565 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.7 m -105.64 151.0 7.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.432 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 378' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.66 152.58 20.79 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.197 -179.055 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 379' ' ' CYS . . . . . 0.599 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.64 142.57 46.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.599 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.52 HD23 HG22 ' B' ' 461' ' ' THR . 5.3 mt -132.76 101.18 5.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 381' ' ' MET . . . . . 0.455 ' HB3' ' HB ' ' B' ' 460' ' ' VAL . 18.3 ttp -116.65 165.92 12.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.596 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 382' ' ' ASN . . . . . 0.493 HD21 ' NH1' ' A' ' 50' ' ' ARG . 13.3 t30 58.31 51.13 8.69 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 123.536 0.523 . . . . 0.0 111.256 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 383' ' ' MET . . . . . 0.43 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.81 14.32 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.271 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 384' ' ' VAL . . . . . 0.712 HG21 HG23 ' B' ' 432' ' ' ILE . 0.4 OUTLIER -152.3 125.13 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.829 0.347 . . . . 0.0 111.326 179.878 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.415 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.67 151.74 43.01 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.406 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.1 -23.46 73.38 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.265 1.976 . . . . 0.0 112.352 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.86 -5.53 53.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.04 -36.69 5.79 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.909 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 389' ' ' LEU . . . . . 0.473 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -83.05 34.91 0.47 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.946 0.403 . . . . 0.0 110.603 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 390' ' ' LEU . . . . . 0.528 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.47 -15.73 5.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.726 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -98.28 148.74 23.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.582 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -73.56 -30.34 62.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.186 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.31 -47.68 26.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.729 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -64.48 -44.33 91.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.801 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -56.4 -59.4 5.02 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.211 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.95 -27.35 61.06 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.23 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.18 -40.99 67.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.42 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 398' ' ' ILE . . . . . 0.496 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.9 -53.68 15.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.513 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 399' ' ' VAL . . . . . 0.628 HG22 HD12 ' B' ' 417' ' ' ILE . 59.5 t -53.34 -46.86 58.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.795 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.51 -59.92 3.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.516 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.68 -57.13 11.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.385 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.14 -32.83 15.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.375 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 403' ' ' ARG . . . . . 0.455 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.21 -57.43 4.5 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.746 0.307 . . . . 0.0 111.145 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.88 -33.64 64.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.177 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 405' ' ' GLU . . . . . 0.558 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.8 mm-40 -73.5 -47.02 44.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.978 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.83 -23.97 67.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.164 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.04 30.27 1.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.972 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.11 -17.07 12.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.89 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.67 -15.52 14.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.52 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.16 -139.41 4.14 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.601 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 411' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' B' ' 411' ' ' LEU . 1.6 mm? -114.25 132.47 56.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.769 0.319 . . . . 0.0 111.086 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 412' ' ' VAL . . . . . 0.426 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.39 115.49 48.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 121.061 0.457 . . . . 0.0 110.593 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . 0.694 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.63 -61.98 2.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.184 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.9 p -152.96 -169.35 3.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.113 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 415' ' ' ILE . . . . . 0.615 HG23 HG12 ' B' ' 434' ' ' VAL . 48.8 mt -145.2 128.92 11.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.859 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 416' ' ' GLU . . . . . 0.437 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.8 108.8 18.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.746 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 417' ' ' ILE . . . . . 0.969 HG23 HG21 ' B' ' 432' ' ' ILE . 61.1 mt -128.53 108.59 19.03 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.643 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 418' ' ' PRO . . . . . 0.649 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.48 147.56 8.98 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.689 2.259 . . . . 0.0 112.903 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 419' ' ' ARG . . . . . 0.528 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.83 74.74 22.11 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.158 179.778 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -47.19 117.1 2.05 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.758 2.305 . . . . 0.0 112.475 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 421' ' ' VAL . . . . . 0.594 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.5 t -74.39 97.81 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.189 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.64 21.73 9.08 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.535 0.683 . . . . 0.0 109.29 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 423' ' ' GLY . . . . . 0.639 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.31 29.29 6.07 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.291 -179.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 424' ' ' VAL . . . . . 0.594 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.0 OUTLIER -76.45 -37.51 30.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.17 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.85 35.78 4.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.793 0.33 . . . . 0.0 111.771 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 426' ' ' VAL . . . . . 0.675 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.32 -44.69 47.98 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.74 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 427' ' ' PRO . . . . . 0.675 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 17.9 Cg_endo -66.26 77.05 0.34 Allowed 'Trans proline' 0 N--CA 1.461 -0.406 0 C-N-CA 122.477 2.118 . . . . 0.0 111.102 179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.34 -15.43 3.2 Favored Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.339 -178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.5 t -67.54 149.4 50.19 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.596 0.236 . . . . 0.0 110.729 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.5 -14.24 5.06 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.841 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.41 126.13 44.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.819 0.342 . . . . 0.0 111.024 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 432' ' ' ILE . . . . . 0.969 HG21 HG23 ' B' ' 417' ' ' ILE . 7.9 pt -131.04 172.92 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.264 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 433' ' ' PHE . . . . . 0.599 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.51 -176.4 2.81 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.981 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 434' ' ' VAL . . . . . 0.615 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.73 141.74 41.21 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.193 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 435' ' ' GLU . . . . . 0.484 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.6 tt0 -84.37 108.48 17.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.778 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.78 168.32 12.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.256 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 437' ' ' THR . . . . . 0.694 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.91 -45.34 7.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.474 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.91 146.6 52.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.004 0.431 . . . . 0.0 111.215 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.22 -12.78 16.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.215 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.54 -54.79 26.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.086 0.469 . . . . 0.0 110.189 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -75.18 -29.54 60.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.789 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 442' ' ' CYS . . . . . 0.418 ' O ' ' HG2' ' B' ' 446' ' ' MET . 0.3 OUTLIER -62.13 -31.76 72.27 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.185 179.257 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.68 -48.08 15.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.611 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.58 -11.99 59.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.776 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.86 -55.9 3.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.939 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 446' ' ' MET . . . . . 0.602 ' HB3' HD21 ' B' ' 378' ' ' LEU . 1.9 ptp -62.87 -29.17 70.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.142 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -68.41 -16.2 63.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.603 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.63 -8.62 22.52 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.367 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 449' ' ' LEU . . . . . 0.409 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.2 mt -95.69 -19.65 19.53 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.711 0.291 . . . . 0.0 110.925 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 450' ' ' THR . . . . . 0.55 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 39.9 p -70.02 132.22 45.56 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.087 175.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.31 -9.19 78.08 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.546 -0.835 . . . . 0.0 113.384 176.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 452' ' ' ARG . . . . . 0.432 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.14 -152.2 0.04 OUTLIER 'General case' 0 C--O 1.232 0.153 0 CA-C-N 117.322 0.561 . . . . 0.0 110.517 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 453' ' ' LYS . . . . . 0.467 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.85 117.08 2.27 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.359 . . . . 0.0 111.324 -179.866 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -59.29 -36.36 75.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.494 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.21 -50.91 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.817 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 456' ' ' ASN . . . . . 0.526 ' HB3' ' SD ' ' A' ' 27' ' ' MET . 6.4 p30 -157.22 24.89 0.3 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.783 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 457' ' ' ARG . . . . . 0.43 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.45 136.54 19.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.253 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 8.2 p -56.47 140.17 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.994 176.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 459' ' ' VAL . . . . . . . . . . . . . 50.7 t -101.73 121.67 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -174.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 460' ' ' VAL . . . . . 0.744 HG22 HG12 ' A' ' 53' ' ' ILE . 33.9 t -83.33 100.41 6.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.121 175.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 461' ' ' THR . . . . . 0.52 HG22 HD23 ' B' ' 380' ' ' LEU . 8.2 p -105.62 111.55 24.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.872 0.368 . . . . 0.0 110.94 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 462' ' ' LYS . . . . . 0.845 ' HG2' ' H ' ' A' ' 40' ' ' ILE . 31.7 mtmt -117.65 -164.59 1.01 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.28 0.562 . . . . 0.0 111.271 -177.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -111.75 147.07 36.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.549 178.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 464' ' ' CYS . . . . . 0.565 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.91 148.9 47.29 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.003 0.43 . . . . 0.0 111.373 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 465' ' ' ASP . . . . . 0.462 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.35 129.43 66.41 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.366 -179.858 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 466' ' ' PRO . . . . . 0.486 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.04 -33.4 73.19 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.782 2.321 . . . . 0.0 112.035 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.99 -58.53 7.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.396 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.39 -33.76 68.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.26 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 469' ' ' TYR . . . . . 0.484 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.7 t80 -60.01 -51.27 70.38 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.162 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.39 -47.54 69.43 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.307 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 471' ' ' ARG . . . . . 0.438 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.64 -2.16 49.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.42 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.12 20.78 8.74 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.913 0.387 . . . . 0.0 110.223 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 473' ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' B' ' 474' ' ' PHE . 0.3 OUTLIER -56.66 -20.13 19.88 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.981 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 474' ' ' PHE . . . . . 0.482 ' HB2' ' O ' ' B' ' 473' ' ' ASP . 3.3 m-30 72.92 32.67 1.34 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.331 0.652 . . . . 0.0 111.319 -178.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 475' ' ' TRP . . . . . 0.415 ' HB2' ' SG ' ' B' ' 464' ' ' CYS . 14.0 t90 . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.626 -0.702 . . . . 0.0 111.614 178.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.7 ttm . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.785 0.326 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -91.12 102.68 15.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.162 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.1 p -123.76 -21.01 5.29 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.322 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 133.51 -20.62 4.13 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.978 -0.63 . . . . 0.0 112.012 -178.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -101.02 -42.2 6.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.799 0.333 . . . . 0.0 111.016 178.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -97.16 99.89 11.37 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.844 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -115.92 102.03 9.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.849 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.465 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 35.7 p -90.86 131.84 36.32 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.489 -178.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 8' ' ' THR . 5.2 Cg_exo -74.99 143.76 29.47 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.359 2.706 . . . . 0.0 112.933 -178.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 15.5 tp -117.56 134.31 55.0 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.288 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -124.47 -4.56 7.76 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -175.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -86.98 133.88 38.2 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.982 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -57.07 115.51 2.55 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.624 2.216 . . . . 0.0 112.378 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.05 -166.77 1.32 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 mptt 55.4 51.93 12.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.894 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.42 -36.19 3.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.952 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -146.75 91.9 2.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.886 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -163.9 -54.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.832 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.472 ' NH2' ' HB3' ' A' ' 74' ' ' PRO . 1.7 tpt180 -127.89 111.22 13.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.96 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.99 125.56 24.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.713 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -112.55 12.72 19.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.024 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . 0.568 ' HZ3' HG11 ' B' ' 459' ' ' VAL . 71.8 m95 -141.97 53.09 1.48 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.798 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -80.2 -156.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.858 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.486 ' HA ' ' HD2' ' B' ' 453' ' ' LYS . 28.8 pt20 -169.36 -37.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.879 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.429 ' OD1' ' HB ' ' A' ' 33' ' ' ILE . 0.2 OUTLIER -114.71 120.6 40.64 Favored 'General case' 0 C--O 1.242 0.669 0 CA-C-O 118.956 -0.545 . . . . 0.0 110.598 179.961 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.492 HG21 ' HA3' ' A' ' 71' ' ' GLY . 81.0 p -93.18 -23.67 18.49 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 123.63 0.581 . . . . 0.0 111.238 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -87.94 169.9 11.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.607 177.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.74 139.87 56.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.724 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -68.04 116.33 8.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.347 0.594 . . . . 0.0 111.947 -176.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.408 ' H ' ' H ' ' A' ' 31' ' ' THR . 18.1 ptpt -153.01 -14.77 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.089 176.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.408 ' H ' ' H ' ' A' ' 30' ' ' LYS . 7.7 t -134.36 158.1 44.68 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.7 179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.1 p -75.01 135.7 26.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-O 121.109 0.48 . . . . 0.0 111.039 179.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.481 HD12 ' HD2' ' A' ' 34' ' ' PRO . 2.4 tp -104.38 118.66 56.18 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.969 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.481 ' HD2' HD12 ' A' ' 33' ' ' ILE . 9.4 Cg_exo -71.27 117.12 4.99 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.565 2.176 . . . . 0.0 111.845 175.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -113.93 87.27 0.44 Allowed Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.919 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 94.5 mmm -71.33 129.71 88.64 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 120.573 0.225 . . . . 0.0 111.451 -178.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -60.0 146.03 96.97 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.89 2.394 . . . . 0.0 111.599 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.732 ' HB ' HG13 ' B' ' 460' ' ' VAL . 71.3 p -114.07 41.37 2.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.167 0.508 . . . . 0.0 110.815 -174.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.686 HG13 HG21 ' B' ' 450' ' ' THR . 3.1 m -104.75 116.99 49.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.774 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.865 HG21 ' HG2' ' A' ' 49' ' ' GLU . 6.3 mt -95.96 131.53 28.83 Favored Pre-proline 0 CA--C 1.536 0.411 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.338 -177.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.542 ' HB2' HD23 ' A' ' 44' ' ' LEU . 51.6 Cg_exo -55.87 156.78 18.21 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.901 3.067 . . . . 0.0 113.879 -177.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 41' ' ' PRO . 19.2 Cg_exo -67.27 -29.87 38.18 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 123.641 2.894 . . . . 0.0 114.139 -176.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -95.35 49.47 1.89 Allowed Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.505 -0.855 . . . . 0.0 112.588 -177.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.542 HD23 ' HB2' ' A' ' 41' ' ' PRO . 1.1 mm? -117.82 152.69 34.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.723 0.297 . . . . 0.0 111.358 -174.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.507 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.6 p -95.12 156.62 16.24 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.159 175.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.518 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -61.21 -31.35 71.12 Favored 'General case' 0 C--O 1.24 0.596 0 CA-C-O 120.889 0.376 . . . . 0.0 111.301 -174.663 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.437 ' OE1' ' HB ' ' A' ' 45' ' ' THR . 3.1 mp0 -72.36 -45.13 61.22 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -69.23 -33.05 72.69 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.731 -177.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.865 ' HG2' HG21 ' A' ' 40' ' ' ILE . 44.5 mt-10 -60.55 -45.3 94.38 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.221 177.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.552 ' O ' HG22 ' A' ' 54' ' ' VAL . 15.9 mmt180 -63.05 -43.34 98.93 Favored 'General case' 0 C--O 1.185 -2.318 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.29 177.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.556 ' HA ' HG22 ' A' ' 54' ' ' VAL . . . -58.33 -40.77 83.01 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 123.771 0.669 . . . . 0.0 111.571 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -67.55 -46.48 72.63 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 122.175 -0.328 . . . . 0.0 110.759 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.788 HG13 HD11 ' A' ' 40' ' ' ILE . 87.2 mt -58.52 -51.16 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 110.751 176.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.556 HG22 ' HA ' ' A' ' 51' ' ' ALA . 35.0 m -66.67 -35.6 75.2 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.744 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.919 -175.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.16 -44.91 92.14 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.537 0.608 . . . . 0.0 110.312 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.487 ' HA ' ' HG2' ' A' ' 59' ' ' GLU . 0.0 OUTLIER -70.15 -28.08 65.06 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.828 179.358 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.523 HE21 HD21 ' B' ' 382' ' ' ASN . 15.8 mt-30 -74.34 -38.49 63.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.231 174.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.481 HD13 HD13 ' A' ' 113' ' ' ILE . 72.7 mt -62.53 -47.04 94.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 CA-C-N 114.871 -1.058 . . . . 0.0 110.374 178.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 56' ' ' LEU . 7.3 pt-20 -67.4 -41.51 84.84 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 120.345 -0.542 . . . . 0.0 110.689 -179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -67.42 -34.36 77.08 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.257 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.53 ' O ' ' HB3' ' A' ' 64' ' ' LYS . 17.7 mt -67.18 -44.91 78.49 Favored 'General case' 0 C--O 1.207 -1.175 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 174.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.2 m -65.67 -35.72 81.58 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -178.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.497 ' O ' HG22 ' A' ' 67' ' ' THR . 39.2 ttp180 -55.76 -42.8 75.98 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 122.111 0.958 . . . . 0.0 108.516 176.181 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.53 ' HB3' ' O ' ' A' ' 61' ' ' LEU . 22.1 ttmt -61.79 -47.73 83.84 Favored 'General case' 0 N--CA 1.432 -1.333 0 CA-C-N 113.797 -1.547 . . . . 0.0 111.898 179.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.418 HD23 ' O ' ' A' ' 61' ' ' LEU . 0.1 OUTLIER -72.21 -28.89 63.47 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 119.792 -0.763 . . . . 0.0 111.812 177.077 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 54.0 mtp180 -68.05 -47.06 69.38 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -179.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.497 HG22 ' O ' ' A' ' 63' ' ' ARG . 9.0 t -105.16 -17.52 14.45 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.971 -0.692 . . . . 0.0 112.846 -177.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 92.74 29.44 10.74 Favored Glycine 0 C--N 1.315 -0.592 0 C-N-CA 119.87 -1.157 . . . . 0.0 111.285 -177.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -82.44 90.05 6.68 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.163 0.506 . . . . 0.0 110.147 -179.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.0 tp -92.73 -54.94 3.56 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 121.692 -0.63 . . . . 0.0 112.3 -170.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.492 ' HA3' HG21 ' A' ' 26' ' ' THR . . . 61.2 97.94 0.01 OUTLIER Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.079 -178.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.433 ' HA ' ' HD3' ' A' ' 73' ' ' PRO . 10.7 pt -81.49 128.22 70.52 Favored Pre-proline 0 C--N 1.329 -0.313 0 O-C-N 122.569 -0.371 . . . . 0.0 111.986 -178.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.55 ' HG3' ' ND2' ' B' ' 456' ' ' ASN . 29.0 Cg_exo -62.94 135.47 51.72 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.124 2.549 . . . . 0.0 112.866 178.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.472 ' HB3' ' NH2' ' A' ' 19' ' ' ARG . 21.8 Cg_exo -66.87 131.35 25.38 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.141 2.561 . . . . 0.0 112.196 177.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -129.57 97.96 23.63 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.993 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.59 104.52 1.16 Allowed 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 123.215 2.61 . . . . 0.0 112.229 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 68.03 158.81 0.15 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.586 0.708 . . . . 0.0 112.373 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -119.52 164.33 15.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.688 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.8 mtt180 -74.8 -51.93 12.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.253 177.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.46 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 50.5 p -95.18 122.07 60.69 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.042 174.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 80' ' ' SER . 28.6 Cg_exo -61.82 129.89 29.25 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.774 2.316 . . . . 0.0 112.471 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 46.7 t -145.55 101.33 4.33 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.65 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -74.95 -20.55 16.87 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.696 2.264 . . . . 0.0 112.808 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.451 ' HA ' ' HD3' ' A' ' 85' ' ' PRO . 39.5 tt0 -139.35 116.49 8.58 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.963 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 84' ' ' GLU . 10.8 Cg_exo -71.43 107.92 2.26 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.803 2.335 . . . . 0.0 112.418 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.5 mt -90.6 110.6 22.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.558 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -148.0 140.23 24.26 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.261 -176.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -92.54 116.3 28.88 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.673 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.9 m -74.28 -38.76 63.3 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.537 -178.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 69.95 112.3 0.05 Allowed 'General case' 0 N--CA 1.47 0.546 0 O-C-N 123.8 0.687 . . . . 0.0 111.713 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -115.51 27.74 8.24 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.522 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -76.71 -51.64 11.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.939 0.4 . . . . 0.0 110.713 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -95.59 140.84 29.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.597 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.495 ' H ' HD23 ' A' ' 94' ' ' LEU . 1.7 pt? -74.21 -22.02 59.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.124 176.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -119.35 105.44 11.3 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.049 175.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -151.83 -50.2 0.11 Allowed 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -72.12 -52.46 16.64 Favored 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.27 -0.894 . . . . 0.0 109.7 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.463 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 40.5 mp0 -53.23 -51.76 61.12 Favored 'General case' 0 CA--C 1.502 -0.889 0 CA-C-N 113.612 -1.631 . . . . 0.0 110.702 -178.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -66.69 -38.69 87.28 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 113.428 -1.714 . . . . 0.0 110.632 -177.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.529 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 41.3 ttp180 -59.95 -44.5 94.34 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 123.154 0.284 . . . . 0.0 110.369 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.718 ' O ' ' HG ' ' A' ' 105' ' ' LEU . 15.3 m -68.91 -50.11 52.3 Favored 'General case' 0 N--CA 1.428 -1.538 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.677 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.451 ' O ' ' HG3' ' A' ' 106' ' ' GLU . 20.8 mtm180 -65.41 -41.3 93.78 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -175.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -66.04 -39.17 89.95 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 178.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.535 ' O ' ' HG2' ' A' ' 108' ' ' GLU . 6.2 tmtt? -60.25 -40.11 89.13 Favored 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.718 ' HG ' ' O ' ' A' ' 101' ' ' THR . 69.3 mt -63.93 -41.04 97.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.679 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 102' ' ' ARG . 29.7 mt-10 -65.05 -34.4 78.32 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.805 178.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -69.48 -34.33 74.19 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 177.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 5.2 mm-40 -63.48 -48.83 76.05 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 175.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.545 ' O ' HG12 ' A' ' 113' ' ' ILE . 59.1 ttp180 -61.38 -45.48 94.2 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.493 -1.23 . . . . 0.0 110.352 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -62.3 -37.4 85.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 123.53 0.732 . . . . 0.0 111.027 -178.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -57.83 -43.72 85.99 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.5 ' CD1' ' HB3' ' A' ' 57' ' ' GLN . 65.7 mt -72.2 -38.63 68.99 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.771 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.545 HG12 ' O ' ' A' ' 109' ' ' ARG . 48.1 mm -57.36 -50.86 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 CA-C-O 120.538 0.208 . . . . 0.0 110.552 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 95.8 m -60.72 -39.53 88.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.289 0.566 . . . . 0.0 110.529 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.608 ' O ' ' HG ' ' A' ' 119' ' ' LEU . 38.4 tt0 -67.96 -49.54 61.12 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.024 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 27.2 ttt -66.34 -37.15 84.68 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -177.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.8 t -65.58 -36.83 78.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.74 80.24 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.245 0.545 . . . . 0.0 110.248 177.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 115' ' ' GLU . 66.6 mt -71.43 -40.59 70.33 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.055 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -133.62 111.15 12.47 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.011 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -68.68 -22.72 37.14 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.819 2.346 . . . . 0.0 112.577 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.28 0.04 56.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.137 -177.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -64.89 134.64 54.44 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.627 -178.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -105.37 109.23 62.97 Favored Pre-proline 0 CA--C 1.51 -0.583 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.211 177.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -68.32 157.88 59.94 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.293 1.995 . . . . 0.0 111.553 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -55.63 154.51 25.14 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 123.603 2.869 . . . . 0.0 111.711 178.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -68.03 -28.46 67.41 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -173.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -73.6 -8.62 56.71 Favored 'General case' 0 N--CA 1.465 0.279 0 O-C-N 123.728 0.642 . . . . 0.0 111.868 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -68.97 131.5 45.18 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 176.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 131' ' ' PRO . 47.9 mmtm -113.47 118.19 43.89 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-O 120.767 0.318 . . . . 0.0 111.795 -176.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 130' ' ' LYS . 6.5 Cg_exo -75.16 167.6 26.54 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.286 2.657 . . . . 0.0 111.766 174.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -80.93 32.06 0.51 Allowed 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.555 2.17 . . . . 0.0 113.089 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . 65.24 -175.87 0.18 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.258 0.623 . . . . 0.0 112.163 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 2.9 m -127.04 -14.75 5.46 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.89 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 135' ' ' ARG . 44.9 mtm-85 -74.5 105.42 5.62 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.159 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 53.8 t -124.25 128.85 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.155 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.64 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 42.5 t -74.71 -69.6 0.45 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.919 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -133.84 129.87 37.1 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.582 177.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.509 ' HD3' ' H ' ' A' ' 139' ' ' LYS . 0.0 OUTLIER -127.87 -29.98 2.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.075 -179.649 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 3.0 m -104.89 121.58 56.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.001 0.429 . . . . 0.0 110.91 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' MET . . . . . . . . . . . . . 65.6 mtt -101.32 144.77 29.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.023 -178.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.419 ' HB ' ' HD2' ' A' ' 143' ' ' PRO . 43.1 pt -95.87 158.1 34.82 Favored Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.069 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' PRO . . . . . 0.419 ' HD2' ' HB ' ' A' ' 142' ' ' ILE . 32.7 Cg_endo -65.01 140.2 64.85 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.694 2.263 . . . . 0.0 112.527 178.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 59.4 tp60 -93.78 129.97 39.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.882 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 17.4 t70 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.044 -0.979 . . . . 0.0 111.177 179.919 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 372' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 CA-C-O 120.039 -0.312 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 373' ' ' HIS . . . . . . . . . . . . . 41.7 t-80 64.28 104.22 0.03 OUTLIER Pre-proline 0 N--CA 1.47 0.55 0 C-N-CA 123.192 0.597 . . . . 0.0 111.349 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 374' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -68.74 132.8 25.85 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.924 2.416 . . . . 0.0 113.662 -177.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 375' ' ' THR . . . . . 0.464 ' OG1' ' HA ' ' B' ' 465' ' ' ASP . 0.5 OUTLIER -117.78 -71.32 0.74 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.168 174.196 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 376' ' ' GLU . . . . . 0.49 ' HB3' ' HD3' ' B' ' 466' ' ' PRO . 3.7 tp10 -176.87 -45.88 0.01 OUTLIER 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.071 0.396 . . . . 0.0 112.071 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 377' ' ' VAL . . . . . 0.564 HG22 ' O ' ' B' ' 464' ' ' CYS . 4.6 m -105.64 150.97 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.112 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.448 -179.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 378' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' B' ' 446' ' ' MET . 0.2 OUTLIER -90.65 152.51 20.83 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.179 -179.052 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 379' ' ' CYS . . . . . 0.603 ' HA ' ' HB3' ' B' ' 433' ' ' PHE . 40.6 t -115.49 142.5 46.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.636 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.518 HD11 HG13 ' B' ' 434' ' ' VAL . 5.3 mt -132.73 101.64 5.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.897 0.379 . . . . 0.0 111.046 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 381' ' ' MET . . . . . 0.479 ' O ' HG23 ' B' ' 459' ' ' VAL . 27.0 ttp -117.97 165.13 14.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.604 -179.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 382' ' ' ASN . . . . . 0.523 HD21 HE21 ' A' ' 57' ' ' GLN . 13.4 t30 58.85 51.19 7.69 Favored 'General case' 0 C--N 1.34 0.158 0 O-C-N 123.508 0.505 . . . . 0.0 111.387 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 383' ' ' MET . . . . . 0.439 ' HA ' ' HE ' ' B' ' 457' ' ' ARG . 3.0 ptm -164.85 14.38 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.228 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 384' ' ' VAL . . . . . 0.71 HG21 HG23 ' B' ' 432' ' ' ILE . 0.5 OUTLIER -152.29 125.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.885 0.374 . . . . 0.0 111.315 179.878 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.416 ' O ' ' HG ' ' B' ' 389' ' ' LEU . 20.1 mt -110.76 151.72 43.05 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.402 179.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 386' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.15 -23.44 73.11 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.317 2.011 . . . . 0.0 112.297 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 387' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.91 -5.49 53.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.52 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 388' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -110.03 -36.77 5.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.911 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 389' ' ' LEU . . . . . 0.481 HD11 ' HB ' ' B' ' 384' ' ' VAL . 6.5 mt -82.94 34.92 0.46 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.984 0.421 . . . . 0.0 110.684 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 390' ' ' LEU . . . . . 0.554 HD23 HH21 ' B' ' 419' ' ' ARG . 0.5 OUTLIER -126.51 -15.7 5.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.695 179.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 391' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -98.41 148.72 23.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.521 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 392' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -73.52 -30.28 63.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.176 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 393' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -75.28 -47.73 26.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.69 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 394' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.58 -44.3 91.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.71 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 395' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -56.33 -59.39 5.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.184 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 396' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.07 -27.26 61.56 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.202 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 397' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -72.2 -41.05 67.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.39 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 398' ' ' ILE . . . . . 0.492 HD13 HG12 ' B' ' 384' ' ' VAL . 65.4 mt -74.91 -53.65 16.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.5 -179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 399' ' ' VAL . . . . . 0.618 HG22 HD12 ' B' ' 417' ' ' ILE . 59.8 t -53.28 -46.96 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.805 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 400' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -64.46 -59.97 3.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.517 -179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 401' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.64 -57.18 11.73 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.356 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . . . . . . . . . 24.5 t -52.12 -32.83 15.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.361 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 403' ' ' ARG . . . . . 0.439 ' HA ' HD11 ' B' ' 415' ' ' ILE . 0.3 OUTLIER -71.22 -57.38 4.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.165 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 404' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.91 -33.64 64.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.198 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 405' ' ' GLU . . . . . 0.558 ' HG3' ' HE1' ' A' ' 22' ' ' TRP . 21.9 mm-40 -73.46 -47.03 44.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.963 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 406' ' ' CYS . . . . . . . . . . . . . 3.0 m -63.84 -24.0 67.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.154 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.04 30.34 1.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.957 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 408' ' ' LYS . . . . . . . . . . . . . 1.8 mttm -113.07 -17.16 12.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.93 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 409' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -106.72 -15.39 14.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.503 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 410' ' ' GLY . . . . . . . . . . . . . . . 178.13 -139.43 4.16 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.574 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 411' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -114.26 132.46 56.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.726 0.298 . . . . 0.0 111.079 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 412' ' ' VAL . . . . . 0.424 HG13 ' O ' ' B' ' 412' ' ' VAL . 7.5 p -117.38 115.46 48.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.052 0.453 . . . . 0.0 110.6 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . 0.665 ' HG3' HG22 ' B' ' 437' ' ' THR . 10.9 mttt -56.62 -62.04 2.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.136 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 414' ' ' SER . . . . . . . . . . . . . 4.8 p -152.98 -169.36 3.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.147 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 415' ' ' ILE . . . . . 0.603 HG23 HG12 ' B' ' 434' ' ' VAL . 48.2 mt -145.1 128.97 12.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.876 179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 416' ' ' GLU . . . . . 0.434 ' HB2' ' CE2' ' B' ' 469' ' ' TYR . 0.9 OUTLIER -110.88 108.83 18.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.674 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 417' ' ' ILE . . . . . 0.986 HG23 HG21 ' B' ' 432' ' ' ILE . 60.5 mt -128.58 108.5 18.94 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.663 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 418' ' ' PRO . . . . . 0.63 ' HD2' HG22 ' B' ' 432' ' ' ILE . 6.7 Cg_endo -48.47 147.62 8.9 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.621 2.214 . . . . 0.0 112.886 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 419' ' ' ARG . . . . . 0.554 HH21 HD23 ' B' ' 390' ' ' LEU . 0.0 OUTLIER -141.91 74.74 21.82 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.141 179.841 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 420' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -47.17 117.08 2.03 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.729 2.286 . . . . 0.0 112.497 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 421' ' ' VAL . . . . . 0.598 ' H ' ' HB ' ' B' ' 424' ' ' VAL . 96.0 t -74.44 97.86 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.128 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 422' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 58.59 21.77 9.04 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.559 0.695 . . . . 0.0 109.358 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 423' ' ' GLY . . . . . 0.618 ' HA2' HG23 ' B' ' 426' ' ' VAL . . . 102.25 29.31 6.09 Favored Glycine 0 N--CA 1.444 -0.819 0 CA-C-N 114.79 -1.096 . . . . 0.0 111.306 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 424' ' ' VAL . . . . . 0.598 ' HB ' ' H ' ' B' ' 421' ' ' VAL . 1.1 t -76.51 -37.5 30.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.152 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 425' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -122.92 35.93 4.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.777 0.323 . . . . 0.0 111.741 -179.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 426' ' ' VAL . . . . . 0.666 ' N ' ' HD2' ' B' ' 427' ' ' PRO . 2.8 t -67.37 -44.68 47.49 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.759 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 427' ' ' PRO . . . . . 0.666 ' HD2' ' N ' ' B' ' 426' ' ' VAL . 18.0 Cg_endo -66.34 77.11 0.34 Allowed 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.488 2.125 . . . . 0.0 111.05 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 428' ' ' GLY . . . . . . . . . . . . . . . 139.3 -15.37 3.22 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.341 -178.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 429' ' ' CYS . . . . . . . . . . . . . 43.4 t -67.54 149.31 50.31 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.649 0.261 . . . . 0.0 110.743 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 430' ' ' GLY . . . . . . . . . . . . . . . 132.61 -14.31 5.03 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.838 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 431' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 126.06 44.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.839 0.352 . . . . 0.0 111.111 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 432' ' ' ILE . . . . . 0.986 HG21 HG23 ' B' ' 417' ' ' ILE . 7.8 pt -130.96 172.91 15.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.252 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 433' ' ' PHE . . . . . 0.603 ' HB3' ' HA ' ' B' ' 379' ' ' CYS . 1.6 p90 -168.5 -176.37 2.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.986 0.422 . . . . 0.0 111.966 -178.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 434' ' ' VAL . . . . . 0.603 HG12 HG23 ' B' ' 415' ' ' ILE . 3.3 m -135.79 141.72 41.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.179 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 435' ' ' GLU . . . . . 0.491 ' HB2' ' CZ ' ' B' ' 469' ' ' TYR . 53.5 tt0 -84.39 108.47 17.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.836 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 436' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.74 168.35 12.56 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.205 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 437' ' ' THR . . . . . 0.665 HG22 ' HG3' ' B' ' 413' ' ' LYS . 27.3 p -94.96 -45.36 7.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.458 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 438' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.93 146.54 52.16 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.041 0.448 . . . . 0.0 111.25 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 439' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.14 -12.8 16.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.26 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -54.89 25.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.141 0.496 . . . . 0.0 110.121 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 441' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -75.06 -29.53 60.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.858 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 442' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -31.79 72.35 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.094 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 443' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -78.63 -48.08 15.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.611 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 444' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -67.54 -12.1 59.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.753 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 445' ' ' ALA . . . . . . . . . . . . . . . -88.8 -55.69 3.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.96 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 446' ' ' MET . . . . . 0.583 ' O ' HG23 ' B' ' 450' ' ' THR . 3.6 ptm -63.74 -28.15 69.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.038 -179.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 447' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -69.06 -16.28 63.66 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.54 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 448' ' ' GLY . . . . . . . . . . . . . . . -111.56 -8.62 22.64 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.487 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 449' ' ' LEU . . . . . 0.4 HD22 ' CH2' ' A' ' 22' ' ' TRP . 97.3 mt -95.73 -19.87 19.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.739 0.304 . . . . 0.0 110.909 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 450' ' ' THR . . . . . 0.726 ' HB ' ' H ' ' A' ' 38' ' ' THR . 43.2 p -70.02 131.74 44.83 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.884 175.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 451' ' ' GLY . . . . . . . . . . . . . . . 91.81 -9.46 76.74 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.531 177.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 452' ' ' ARG . . . . . 0.424 ' HE ' ' HB3' ' A' ' 22' ' ' TRP . 8.4 mmm180 -77.15 -152.16 0.04 OUTLIER 'General case' 0 C--O 1.232 0.142 0 CA-C-N 117.252 0.526 . . . . 0.0 110.505 179.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 453' ' ' LYS . . . . . 0.486 ' HD2' ' HA ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -160.84 117.01 2.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.855 0.359 . . . . 0.0 111.34 -179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 454' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.17 -36.41 75.26 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.538 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 455' ' ' ALA . . . . . . . . . . . . . . . -161.23 -50.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.817 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 456' ' ' ASN . . . . . 0.55 ' ND2' ' HG3' ' A' ' 73' ' ' PRO . 6.4 p30 -157.32 24.84 0.3 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.817 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 457' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' B' ' 383' ' ' MET . 0.0 OUTLIER -149.46 134.58 18.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.294 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 458' ' ' VAL . . . . . . . . . . . . . 6.6 p -66.3 129.69 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.871 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 459' ' ' VAL . . . . . 0.568 HG11 ' HZ3' ' A' ' 22' ' ' TRP . 2.0 p -94.48 122.98 46.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.521 -175.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 460' ' ' VAL . . . . . 0.742 HG21 HG23 ' A' ' 53' ' ' ILE . 41.2 t -92.53 92.91 3.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.35 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 461' ' ' THR . . . . . . . . . . . . . 76.7 p -83.32 142.67 30.91 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.301 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 462' ' ' LYS . . . . . 0.784 ' HE3' HD12 ' A' ' 40' ' ' ILE . 1.3 ttmm -139.01 -164.18 1.61 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.2 0.524 . . . . 0.0 111.337 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 463' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -112.73 146.95 37.84 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.512 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 464' ' ' CYS . . . . . 0.564 ' O ' HG22 ' B' ' 377' ' ' VAL . 0.5 OUTLIER -136.84 148.99 47.45 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.999 0.428 . . . . 0.0 111.456 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 465' ' ' ASP . . . . . 0.464 ' HA ' ' OG1' ' B' ' 375' ' ' THR . 0.3 OUTLIER -81.35 129.39 66.6 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.337 -179.805 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 466' ' ' PRO . . . . . 0.49 ' HD3' ' HB3' ' B' ' 376' ' ' GLU . 9.4 Cg_endo -54.12 -33.22 73.26 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.655 2.236 . . . . 0.0 112.103 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 467' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.07 -58.39 8.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.453 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 468' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -57.51 -33.74 68.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.233 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 469' ' ' TYR . . . . . 0.491 ' CZ ' ' HB2' ' B' ' 435' ' ' GLU . 5.6 t80 -60.07 -51.19 70.69 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.209 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 470' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -53.4 -47.49 69.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.332 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 471' ' ' ARG . . . . . 0.441 ' HD3' ' HB2' ' B' ' 473' ' ' ASP . 0.0 OUTLIER -81.73 -2.11 49.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.399 -179.886 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 59.07 20.78 8.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.905 0.383 . . . . 0.0 110.285 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 473' ' ' ASP . . . . . 0.515 ' O ' ' HB2' ' B' ' 474' ' ' PHE . 0.3 OUTLIER -56.75 -20.48 22.39 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.959 179.927 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 474' ' ' PHE . . . . . 0.515 ' HB2' ' O ' ' B' ' 473' ' ' ASP . 2.8 m-30 77.09 -67.74 0.2 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.967 0.907 . . . . 0.0 111.582 -178.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 475' ' ' TRP . . . . . . . . . . . . . 4.7 m-90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.447 -0.787 . . . . 0.0 111.0 -178.424 . . . . . . . . 0 0 . 1 stop_ save_