data_2n6f_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 2n6f _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 ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.039 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -92.91 166.27 12.48 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 117.085 0.443 . . . . 0.0 112.141 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.6 m95 -50.32 122.14 6.55 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.654 176.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -111.82 124.29 52.05 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.408 ' CE3' ' HA3' ' A' ' 37' ' ' GLY . 98.2 m95 -104.46 136.8 43.34 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.39 0.614 . . . . 0.0 112.169 -175.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.0 m -95.42 172.07 8.31 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.192 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.0 m -90.39 130.97 38.77 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 CA-C-O 121.756 0.788 . . . . 0.0 111.034 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 43.4 t -61.18 134.46 57.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.35 -1.295 . . . . 0.0 112.168 -176.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.9 t -96.8 107.93 39.99 Favored Pre-proline 0 N--CA 1.438 -1.045 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.561 ' O ' ' HB ' ' A' ' 26' ' ' THR . 18.1 Cg_endo -59.55 -19.03 50.3 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.935 2.423 . . . . 0.0 112.713 -176.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.561 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 30.7 m 85.98 -66.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.029 177.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.2 t 68.23 121.69 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.463 0.649 . . . . 0.0 111.081 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 161.05 66.53 0.02 OUTLIER Glycine 0 CA--C 1.494 -1.257 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.407 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 62.07 40.3 12.18 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 39.1 m 76.91 88.91 0.08 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.126 -178.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.63 149.43 16.87 Favored Glycine 0 CA--C 1.503 -0.665 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.4 tp -78.94 116.43 19.25 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.054 0.454 . . . . 0.0 112.089 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.31 162.32 34.9 Favored Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.085 178.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 p -136.13 154.53 50.95 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.465 0.65 . . . . 0.0 112.402 -177.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -125.21 138.44 54.12 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -118.77 129.08 55.05 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.905 0.383 . . . . 0.0 110.999 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.408 ' HA3' ' CE3' ' A' ' 20' ' ' TRP . . . -124.55 143.5 14.72 Favored Glycine 0 N--CA 1.437 -1.238 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 177.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.454 HG23 ' HB3' ' A' ' 48' ' ' MET . 50.7 p -133.3 158.41 43.02 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 117.637 0.719 . . . . 0.0 110.727 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.505 ' HG2' ' N ' ' A' ' 40' ' ' THR . 71.7 ttt180 -154.73 161.1 41.66 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.633 ' HA ' ' O ' ' A' ' 45' ' ' LYS . 1.3 p -106.58 145.79 31.47 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 174.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.89 -176.99 31.57 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.099 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.39 -25.77 63.4 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.567 0.699 . . . . 0.0 110.441 -177.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -98.16 16.36 21.53 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.91 178.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 73.4 m 61.23 79.74 0.24 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.323 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.633 ' O ' ' HA ' ' A' ' 40' ' ' THR . 75.8 mmtt -130.36 146.03 51.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 177.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -74.75 108.46 7.51 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.03 0.443 . . . . 0.0 110.873 -177.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -115.8 136.59 52.91 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.454 ' HB3' HG23 ' A' ' 38' ' ' THR . 16.3 ptm -144.96 154.34 42.47 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -147.71 142.59 26.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.642 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.1 m -116.86 138.81 51.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 120.848 0.356 . . . . 0.0 110.476 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -120.48 152.66 37.71 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -104.78 127.35 52.55 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 57.6 m -90.69 -165.39 1.34 Allowed 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -175.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -117.55 140.06 50.12 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 120.772 0.32 . . . . 0.0 110.921 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 6.9 tp -109.77 120.22 45.53 Favored Pre-proline 0 C--N 1.305 -1.353 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.709 -178.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -62.51 103.44 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.368 2.045 . . . . 0.0 111.37 177.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.313 -0.996 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.572 -179.657 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.094 0 CA-C-O 120.896 0.165 . . . . 0.0 112.797 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -156.2 -79.87 0.08 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -89.6 -20.72 23.39 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 45.0 t -76.24 178.74 6.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.425 176.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -132.76 125.82 31.02 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.53 -178.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.433 ' HE1' ' O ' ' A' ' 100' ' ' GLN . 1.6 t80 -141.23 141.36 34.02 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.766 -177.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -123.7 134.02 53.79 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 110.498 -0.186 . . . . 0.0 110.498 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -97.09 131.64 43.67 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 176.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.432 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 3.6 pt20 -115.66 161.75 18.23 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -135.97 106.04 6.31 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 121.141 0.496 . . . . 0.0 111.288 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 59.3 t90 -79.06 -21.7 46.41 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.211 176.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -159.59 158.46 29.64 Favored Glycine 0 N--CA 1.434 -1.492 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.191 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -94.33 146.63 23.91 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 2.1 t -21.33 126.58 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.225 0 O-C-N 124.563 1.164 . . . . 0.0 112.58 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -98.29 109.16 21.96 Favored 'General case' 0 CA--C 1.494 -1.207 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 mt -75.51 -21.21 58.19 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -177.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -67.17 -36.48 81.89 Favored 'General case' 0 CA--C 1.486 -1.496 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -174.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.414 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 74.1 p -104.87 -7.28 19.48 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.875 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.432 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 61.95 37.31 15.15 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.348 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.433 ' HA ' ' H ' ' A' ' 109' ' ' CYS . 66.3 mt -128.1 152.31 48.14 Favored 'General case' 0 CA--C 1.498 -1.057 0 CA-C-O 121.276 0.56 . . . . 0.0 111.873 -176.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.401 ' HB2' ' HB2' ' A' ' 109' ' ' CYS . 87.0 tttt -135.65 136.48 41.0 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.725 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.1 t -134.52 144.49 48.05 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 120.904 0.383 . . . . 0.0 111.551 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -142.54 142.87 32.28 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.925 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.432 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 5.0 m -112.61 147.21 37.16 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.651 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -133.82 156.49 22.34 Favored Glycine 0 C--N 1.318 -0.467 0 C-N-CA 121.14 -0.552 . . . . 0.0 111.937 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.7 p -146.31 141.7 27.55 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-N 116.955 0.378 . . . . 0.0 111.941 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 5.3 tt -68.78 127.47 33.18 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.331 176.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -97.57 -31.47 12.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.613 178.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -156.77 140.07 15.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.617 0.246 . . . . 0.0 110.876 178.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -113.94 131.51 56.29 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.471 ' HB2' ' HB2' ' A' ' 97' ' ' ALA . 8.7 mp -93.19 175.94 6.59 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -178.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -76.7 -27.94 55.68 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.692 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -126.49 14.09 7.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.028 0.918 . . . . 0.0 110.698 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.471 ' HB2' ' HB2' ' A' ' 94' ' ' LEU . . . -143.23 91.2 2.25 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.111 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -103.61 152.63 21.53 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.721 -176.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 67.8 m -134.91 156.19 49.4 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 121.295 0.569 . . . . 0.0 111.855 -177.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.598 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 19.5 pm0 -64.02 149.91 46.43 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.801 -1.091 . . . . 0.0 108.449 169.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.51 ' HA ' ' HB3' ' A' ' 90' ' ' LEU . 57.3 pttt -81.52 -31.69 32.68 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -173.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.0 t -155.69 148.82 24.55 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 119.387 -0.925 . . . . 0.0 112.451 177.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 26.8 m -134.27 143.02 39.3 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.15 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.275 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 12.2 t -128.18 128.95 45.72 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-N 114.482 -1.236 . . . . 0.0 107.912 175.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.9 tt -141.07 139.69 33.23 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 CA-C-O 121.221 0.534 . . . . 0.0 111.375 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 16.3 m -130.41 127.48 39.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -133.52 132.53 21.91 Favored Pre-proline 0 C--N 1.305 -1.365 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -51.21 118.07 3.98 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 121.561 1.507 . . . . 0.0 110.956 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.433 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 9.4 t -77.52 -30.06 52.71 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.239 -176.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.279 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 178.026 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' A' ' 40' ' ' THR . . . . . . . . 0 N--CA 1.435 -1.38 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -109.46 166.17 11.09 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.518 0.675 . . . . 0.0 111.243 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 98.6 m95 -65.08 128.98 38.05 Favored 'General case' 0 N--CA 1.418 -2.067 0 CA-C-N 114.462 -1.245 . . . . 0.0 111.413 174.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -87.66 137.96 31.88 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 176.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -110.27 124.02 50.87 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 121.324 0.583 . . . . 0.0 112.329 -174.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.0 m -107.13 168.51 9.16 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.21 -0.905 . . . . 0.0 108.961 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.6 m -96.51 152.9 3.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.569 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 79.3 m -66.91 129.85 41.24 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.788 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 17.1 m -109.29 111.1 60.14 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.799 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.06 156.83 63.96 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.404 2.07 . . . . 0.0 111.686 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.6 m -91.25 -25.81 19.31 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-O 121.247 0.546 . . . . 0.0 109.549 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -160.56 136.75 8.54 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.644 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -69.94 -26.96 73.69 Favored Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -80.99 54.24 2.16 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.4 m 59.41 88.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.114 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.432 ' H ' HD13 ' A' ' 55' ' ' ILE . . . -144.34 141.82 10.48 Favored Glycine 0 N--CA 1.437 -1.252 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.531 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.7 tp -57.04 152.15 13.73 Favored 'General case' 0 C--O 1.203 -1.392 0 C-N-CA 122.502 0.321 . . . . 0.0 111.38 -177.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.0 171.77 22.31 Favored Glycine 0 N--CA 1.438 -1.23 0 N-CA-C 110.57 -1.012 . . . . 0.0 110.57 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.4 p -135.68 154.18 51.37 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 117.441 0.62 . . . . 0.0 112.06 -178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -137.09 142.2 42.35 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 175.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -130.25 130.87 45.14 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 120.757 0.313 . . . . 0.0 111.627 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.54 145.81 17.52 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 71.2 p -134.91 154.76 51.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 117.843 0.821 . . . . 0.0 111.115 -177.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -118.11 154.51 31.99 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.4 ' O ' ' HA3' ' A' ' 16' ' ' GLY . 2.2 m -150.73 161.87 41.8 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.387 -175.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 166.16 -173.44 41.68 Favored Glycine 0 N--CA 1.434 -1.47 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.54 -32.72 64.36 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 117.593 0.696 . . . . 0.0 111.411 -178.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -105.52 0.97 27.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.961 0.41 . . . . 0.0 111.843 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 78.2 m -98.71 117.32 32.91 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 120.91 0.386 . . . . 0.0 111.858 -177.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.77 140.56 40.68 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.793 175.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 62.53 19.79 11.49 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.671 0.607 . . . . 0.0 111.466 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -84.11 77.89 9.86 Favored 'General case' 0 N--CA 1.437 -1.105 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 177.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 55.2 mtt -134.31 152.86 52.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.057 -175.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -148.54 131.45 16.15 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.374 178.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.2 m -117.1 138.02 51.91 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -131.62 152.24 50.98 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 120.729 0.299 . . . . 0.0 110.824 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -85.95 129.44 34.83 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 176.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 9.1 t -95.78 178.83 5.32 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -175.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -113.65 141.14 47.58 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.438 0.637 . . . . 0.0 111.284 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.432 HD13 ' H ' ' A' ' 31' ' ' GLY . 12.4 tt -123.59 120.29 26.93 Favored Pre-proline 0 C--N 1.299 -1.605 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.64 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -70.41 98.44 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.375 2.05 . . . . 0.0 111.822 178.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 54.1 t . . . . . 0 C--N 1.313 -0.983 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.924 178.807 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.923 0 N-CA-C 111.626 -0.589 . . . . 0.0 111.626 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.06 -75.99 0.59 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.622 0.248 . . . . 0.0 110.701 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -93.68 -21.58 19.27 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.161 0.505 . . . . 0.0 110.588 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 56.3 m -83.42 160.52 21.56 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.378 178.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -130.81 127.82 39.43 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.831 ' CE2' ' HB2' ' A' ' 90' ' ' LEU . 54.8 m-85 -109.27 128.47 55.1 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.611 -178.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -100.51 117.58 34.94 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 177.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.522 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 44.2 p90 -99.02 145.11 27.41 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-O 120.83 0.347 . . . . 0.0 111.158 -176.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -89.78 162.34 15.57 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 71.74 116.85 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.16 0.912 . . . . 0.0 110.661 -175.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -89.11 -3.12 58.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.757 0.789 . . . . 0.0 109.826 -177.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.92 140.13 11.54 Favored Glycine 0 N--CA 1.436 -1.336 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.943 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -107.98 141.23 39.95 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.565 ' HA ' ' HB3' ' A' ' 84' ' ' LYS . 48.9 t 79.53 102.24 0.07 Allowed 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 121.662 0.744 . . . . 0.0 110.777 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -83.73 111.85 19.54 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 114.874 -1.057 . . . . 0.0 108.51 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -63.82 -31.81 73.12 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.612 -1.176 . . . . 0.0 113.254 -173.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -74.95 -28.7 60.69 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.438 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.625 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.7 p -105.19 -8.55 18.29 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 120.004 -0.678 . . . . 0.0 112.44 -175.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.32 25.08 12.33 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 123.466 0.706 . . . . 0.0 110.625 -175.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.625 ' HG ' ' O ' ' A' ' 81' ' ' THR . 44.9 mt -128.71 149.49 50.67 Favored 'General case' 0 C--O 1.202 -1.437 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.121 -177.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.565 ' HB3' ' HA ' ' A' ' 77' ' ' CYS . 8.3 ptmt -121.58 135.46 55.0 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 120.879 0.371 . . . . 0.0 110.246 177.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.3 m -137.95 138.3 38.82 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -177.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -140.33 136.42 33.19 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 120.814 0.34 . . . . 0.0 110.179 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.5 m -128.75 134.23 48.36 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.63 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.522 ' HA2' ' HA ' ' A' ' 71' ' ' PHE . . . -135.69 152.3 20.92 Favored Glycine 0 CA--C 1.495 -1.214 0 C-N-CA 120.466 -0.874 . . . . 0.0 111.784 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 20.1 p -141.04 146.42 37.18 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.24 0.543 . . . . 0.0 111.961 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.831 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.8 tm? -91.29 121.46 33.05 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -97.4 -12.39 22.81 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -174.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 14.9 ttm180 -161.57 133.76 5.8 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.564 0.221 . . . . 0.0 110.496 178.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -113.6 148.6 35.91 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.8 mp -85.74 172.09 11.09 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 -178.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -78.46 -18.38 54.95 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.112 0.482 . . . . 0.0 110.404 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -119.63 37.6 4.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.698 0.761 . . . . 0.0 109.706 179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -157.63 124.26 4.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.335 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -111.1 122.98 49.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.648 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . 0.453 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 74.7 m -145.68 148.3 32.9 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.956 -0.566 . . . . 0.0 112.177 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.74 152.54 45.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.267 178.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -73.52 -35.72 65.62 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.915 -175.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.402 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 9.3 t -156.26 148.91 23.8 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 118.877 -1.129 . . . . 0.0 113.449 179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.1 m -131.63 139.26 51.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 113.8 -1.546 . . . . 0.0 110.83 175.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 56.7 m -129.74 133.78 47.22 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.411 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.48 132.08 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 4.8 m -131.82 126.28 33.94 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -135.5 138.17 27.89 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -62.71 123.15 11.81 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 121.7 1.6 . . . . 0.0 110.252 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.16 178.37 8.14 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.763 0.316 . . . . 0.0 110.479 -176.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.759 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -177.942 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.799 0 N-CA-C 112.193 -0.363 . . . . 0.0 112.193 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -75.83 171.3 14.62 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 122.46 0.304 . . . . 0.0 110.858 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.637 ' HA ' ' O ' ' A' ' 38' ' ' THR . 88.5 m95 -45.92 119.51 2.27 Favored 'General case' 0 N--CA 1.442 -0.839 0 O-C-N 123.894 0.746 . . . . 0.0 112.698 -177.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.452 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 68.3 mt-30 -113.15 115.56 28.46 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -100.45 138.69 37.17 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.225 0.536 . . . . 0.0 111.481 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.0 t -101.33 172.44 6.99 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.416 -0.811 . . . . 0.0 108.895 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 29.1 m -91.95 148.56 4.56 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 62.3 m -63.6 128.41 35.7 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.829 -175.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 p -106.23 114.79 61.99 Favored Pre-proline 0 N--CA 1.44 -0.93 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -61.29 148.09 93.83 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.599 2.2 . . . . 0.0 112.972 -176.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.3 m -87.64 -28.53 21.81 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-O 121.678 0.752 . . . . 0.0 109.195 178.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 46.3 t -149.95 134.58 17.56 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.888 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.07 -30.57 69.78 Favored Glycine 0 CA--C 1.504 -0.616 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.338 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -68.17 -41.47 81.44 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.3 m 166.02 92.15 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.583 1.153 . . . . 0.0 110.847 178.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -141.31 120.09 1.62 Allowed Glycine 0 CA--C 1.498 -0.976 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.895 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -53.68 114.13 1.43 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.998 0.428 . . . . 0.0 111.671 -176.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.96 175.77 53.96 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.886 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 p -136.42 154.66 50.73 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -133.71 146.04 50.44 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.001 176.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -120.82 131.56 54.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.514 0.197 . . . . 0.0 110.649 -178.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.452 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -128.21 151.37 18.76 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 178.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.637 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 58.8 p -130.0 149.37 51.75 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 117.395 0.598 . . . . 0.0 111.25 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.495 ' HB2' ' CE2' ' A' ' 18' ' ' TRP . 53.2 ttp180 -132.24 161.4 33.53 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.49 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 9.0 t -113.75 162.7 15.97 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-O 121.756 0.788 . . . . 0.0 111.087 178.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -111.82 -174.29 19.67 Favored Glycine 0 C--N 1.294 -1.788 0 CA-C-N 114.042 -1.435 . . . . 0.0 110.058 177.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.94 -30.51 69.83 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 117.562 0.681 . . . . 0.0 110.099 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -101.93 5.44 40.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.412 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.404 ' HA ' ' OG1' ' A' ' 40' ' ' THR . 52.9 t 60.51 70.85 0.6 Allowed 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.991 -175.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -90.89 -18.41 24.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.055 -178.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.423 ' HA ' ' O ' ' A' ' 39' ' ' ARG . 15.3 mm100 66.74 100.56 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.893 0.854 . . . . 0.0 112.829 178.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 m -101.72 143.32 31.8 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 114.74 -1.118 . . . . 0.0 108.542 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -120.85 152.59 38.21 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.18 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -141.89 136.07 30.12 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.9 m -129.77 136.72 49.96 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -133.64 151.1 51.6 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-O 121.053 0.454 . . . . 0.0 111.294 -176.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.481 ' N ' ' HD2' ' A' ' 52' ' ' ARG . 0.2 OUTLIER -101.91 128.1 48.45 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.44 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 31.7 m -92.65 170.58 9.61 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 -174.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.7 mttm -113.79 139.91 48.74 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.371 0.605 . . . . 0.0 112.125 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.9 mt -112.37 131.54 22.55 Favored Pre-proline 0 C--N 1.305 -1.369 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.631 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.447 ' O ' ' HB2' ' A' ' 57' ' ' CYS . 9.5 Cg_endo -52.45 -54.5 5.08 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.426 2.75 . . . . 0.0 113.486 -178.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 56' ' ' PRO . 41.9 m . . . . . 0 N--CA 1.472 0.672 0 C-N-CA 123.085 0.554 . . . . 0.0 112.357 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.949 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -132.66 1.19 3.66 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -82.92 -20.93 34.41 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.245 0.545 . . . . 0.0 110.455 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.5 p -99.67 -176.48 3.28 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 175.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -129.85 142.44 50.67 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.491 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.482 ' HH ' ' NE2' ' A' ' 100' ' ' GLN . 29.6 m-85 -117.44 152.49 34.89 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.01 -178.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -124.96 118.77 26.98 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -95.79 135.57 37.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.201 0.524 . . . . 0.0 111.135 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.446 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 0.2 OUTLIER -110.5 162.17 14.96 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.808 -178.577 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -124.55 87.27 2.69 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.152 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 47.9 t-105 -87.24 -24.35 24.42 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.417 0.627 . . . . 0.0 109.526 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -161.62 118.19 0.81 Allowed Glycine 0 N--CA 1.439 -1.154 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.764 178.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -96.85 116.23 28.8 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.516 ' SG ' ' HG3' ' A' ' 84' ' ' LYS . 55.7 m 59.99 102.06 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.917 0.76 . . . . 0.0 112.022 -176.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -69.81 111.94 5.9 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 177.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 20.2 mt -69.29 -28.93 66.71 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.695 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -65.27 -38.59 90.77 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.219 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 65.7 p -106.72 -14.59 14.97 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.278 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 69.48 39.89 1.53 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.921 -1.036 . . . . 0.0 108.727 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 90.3 mt -125.34 168.01 14.13 Favored 'General case' 0 C--O 1.204 -1.321 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.859 -178.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.516 ' HG3' ' SG ' ' A' ' 77' ' ' CYS . 36.1 tttm -121.15 137.44 54.67 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -177.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 14.2 t -137.12 146.7 45.37 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.495 0.664 . . . . 0.0 110.878 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -137.56 135.54 36.77 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.39 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.446 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 33.4 m -107.44 141.97 38.0 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -136.47 152.57 21.25 Favored Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.459 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 19.0 m -141.08 147.94 39.37 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.063 0.459 . . . . 0.0 111.28 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.1 tm? -72.73 119.03 16.4 Favored 'General case' 0 N--CA 1.408 -2.571 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.388 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -105.39 -25.69 12.27 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 120.429 -0.509 . . . . 0.0 111.114 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -155.85 133.61 11.15 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.042 0.448 . . . . 0.0 111.004 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -135.47 150.72 49.89 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.788 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.4 mp -84.49 158.99 20.82 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 177.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -68.29 -27.08 66.0 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.757 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -100.37 38.85 1.43 Allowed 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.509 0.671 . . . . 0.0 109.304 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.83 99.26 1.39 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.626 -177.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -84.23 133.19 34.59 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.974 179.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 74.8 m -145.94 140.71 27.13 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.811 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.573 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -67.54 153.87 42.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.707 178.647 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.518 ' HD3' ' H ' ' A' ' 101' ' ' LYS . 0.3 OUTLIER -73.93 -26.52 60.56 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.316 -174.671 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 8.8 t -149.22 149.82 31.59 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-O 122.016 0.912 . . . . 0.0 113.043 179.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 29.6 m -129.17 144.04 39.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 113.857 -1.52 . . . . 0.0 110.749 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 34.6 m -129.51 131.8 46.72 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.839 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.09 136.39 47.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.807 0.337 . . . . 0.0 110.358 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.3 p -123.18 137.0 55.0 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.549 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -134.46 128.78 19.32 Favored Pre-proline 0 C--O 1.21 -1.019 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.553 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -50.29 126.21 16.95 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 122.129 1.886 . . . . 0.0 112.394 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.425 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 43.1 t -97.71 107.13 19.56 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.569 -177.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.928 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.072 179.56 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.473 ' O ' ' HD2' ' A' ' 39' ' ' ARG . . . . . . . . 0 N--CA 1.438 -1.2 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -102.91 164.62 11.51 Favored 'General case' 0 CA--C 1.494 -1.198 0 CA-C-N 117.341 0.57 . . . . 0.0 110.552 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.544 ' CD2' ' HB2' ' A' ' 39' ' ' ARG . 74.6 m95 -52.57 118.14 3.4 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.2 mm-40 -119.33 112.74 19.81 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 172.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -97.35 145.08 26.48 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.042 -177.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.8 m -93.77 171.68 8.72 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.955 -1.02 . . . . 0.0 108.583 177.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.3 m -93.53 155.71 3.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.253 -176.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 38.0 t -69.03 99.98 1.16 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 -176.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.2 p -94.48 132.96 27.75 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.652 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.0 110.94 0.75 Allowed 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.641 2.227 . . . . 0.0 111.728 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 97.0 m -65.95 -23.14 66.54 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.146 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.409 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 12.2 t -133.14 176.56 8.4 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.927 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.47 80.26 0.01 OUTLIER Glycine 0 C--N 1.334 0.454 0 O-C-N 124.006 0.816 . . . . 0.0 113.658 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.9 t70 76.67 -38.99 0.33 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.506 1.122 . . . . 0.0 111.939 175.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 47.4 t -123.66 109.61 13.94 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.934 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.409 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -172.94 154.99 22.0 Favored Glycine 0 CA--C 1.491 -1.42 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 -178.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.5 tp -64.13 108.99 1.69 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 118.224 1.012 . . . . 0.0 109.01 178.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.26 175.31 25.12 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.113 -0.948 . . . . 0.0 114.825 -173.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.84 153.66 50.72 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.694 -0.753 . . . . 0.0 111.395 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -144.15 138.35 28.09 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -115.57 132.01 56.76 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.797 -0.183 . . . . 0.0 111.333 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -131.24 136.22 8.69 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 177.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.543 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 6.9 p -123.89 148.24 46.99 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 121.194 -0.202 . . . . 0.0 111.076 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.544 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 11.2 tpt85 -157.01 160.1 38.67 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.402 ' OG1' ' HA3' ' A' ' 16' ' ' GLY . 0.2 OUTLIER -150.58 146.17 26.38 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.513 175.484 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -98.72 -150.35 25.78 Favored Glycine 0 C--O 1.217 -0.967 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.84 -36.56 49.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 118.085 0.942 . . . . 0.0 109.681 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 20.6 mm-40 -85.47 -0.52 55.15 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.216 174.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 5.2 m 40.05 60.57 1.7 Allowed 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.749 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 36.2 mmtm -118.28 141.8 48.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.028 0.442 . . . . 0.0 112.038 -178.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.441 ' O ' ' HG3' ' A' ' 48' ' ' MET . 47.9 mt-30 45.22 -108.34 0.15 Allowed 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.082 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.434 ' O ' ' HB3' ' A' ' 39' ' ' ARG . 0.8 OUTLIER 48.32 27.74 1.43 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 178.693 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.441 ' HG3' ' O ' ' A' ' 46' ' ' GLN . 86.9 mtp -113.96 146.12 40.57 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -147.6 137.37 22.76 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.469 0.652 . . . . 0.0 111.78 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.1 p -114.4 138.46 50.54 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 174.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -134.1 151.53 51.42 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-O 121.875 0.845 . . . . 0.0 112.098 -174.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -85.67 139.05 31.7 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 113.677 -1.601 . . . . 0.0 109.144 172.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 52.9 t -117.98 159.24 23.5 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -173.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.5 tttm -114.27 124.88 53.11 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 52.9 mt -101.94 128.47 28.61 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.413 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.78 48.66 2.25 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 123.131 2.554 . . . . 0.0 113.107 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 26.8 p . . . . . 0 C--N 1.317 -0.833 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.712 179.062 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.667 0 N-CA-C 111.992 -0.443 . . . . 0.0 111.992 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.62 -62.87 1.43 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.878 0.37 . . . . 0.0 110.731 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -86.28 -5.15 59.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.131 0.491 . . . . 0.0 110.505 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 62.8 m -65.73 141.01 58.49 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.686 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -116.8 125.39 51.53 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.454 ' HE2' ' HB2' ' A' ' 90' ' ' LEU . 36.5 m-85 -126.41 146.85 49.91 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -173.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB2' ' HE3' ' A' ' 91' ' ' LYS . 64.2 tt0 -126.49 115.73 20.01 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 106.189 -1.782 . . . . 0.0 106.189 170.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -101.29 156.42 17.46 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -173.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.423 ' O ' ' HB1' ' A' ' 73' ' ' ALA . 35.3 tt0 -78.66 144.76 35.07 Favored 'General case' 0 N--CA 1.4 -2.971 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 172.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.423 ' HB1' ' O ' ' A' ' 72' ' ' GLN . . . 166.5 120.91 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.288 0.367 . . . . 0.0 110.45 -173.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' TRP . . . . . 0.497 ' CZ3' ' HB2' ' A' ' 76' ' ' GLU . 1.1 p-90 -92.16 -8.66 44.95 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.239 0.542 . . . . 0.0 110.379 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 107.87 -39.32 2.94 Favored Glycine 0 CA--C 1.507 -0.437 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.04 175.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.497 ' HB2' ' CZ3' ' A' ' 74' ' ' TRP . 36.9 mt-10 -95.65 142.6 27.77 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 114.978 -0.611 . . . . 0.0 110.34 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 31.0 p -78.31 171.14 15.51 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 176.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -94.06 121.53 35.64 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.491 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 20.8 mt -72.83 -30.15 63.8 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.14 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -67.45 -33.36 74.98 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 121.321 0.581 . . . . 0.0 110.125 -177.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.721 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 76.8 p -104.27 -9.25 18.72 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.643 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.19 24.64 11.62 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.126 0.97 . . . . 0.0 111.475 -177.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 81' ' ' THR . 65.6 mt -131.39 165.08 24.28 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-O 120.961 0.41 . . . . 0.0 110.41 -172.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -119.83 132.71 55.66 Favored 'General case' 0 N--CA 1.414 -2.253 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.2 p -135.14 142.0 46.09 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.027 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.6 mtm180 -139.94 128.49 22.93 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.2 m -99.95 145.34 27.96 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -145.31 149.37 21.49 Favored Glycine 0 N--CA 1.434 -1.478 0 C-N-CA 118.879 -1.629 . . . . 0.0 112.664 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.447 ' HA ' ' O ' ' A' ' 101' ' ' LYS . 29.1 m -132.12 149.34 52.43 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.103 -0.549 . . . . 0.0 111.015 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.1 tm? -75.48 122.04 23.25 Favored 'General case' 0 N--CA 1.414 -2.268 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 70' ' ' GLN . 11.4 ptpt -101.26 -15.23 17.36 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -177.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -162.55 130.82 3.97 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -138.22 144.19 40.5 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.4 mp -91.28 170.54 9.9 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.442 178.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -69.54 -13.42 62.33 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.278 0.561 . . . . 0.0 110.996 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -107.15 29.92 6.67 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.16 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.55 115.95 3.79 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.445 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -87.69 123.46 32.55 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 80.4 m -134.83 139.76 45.32 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.541 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 1.2 pm0 -70.03 145.18 51.93 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.193 176.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' A' ' 89' ' ' SER . 36.4 ttpt -72.25 -42.47 65.62 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.225 -176.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.2 t -152.44 148.19 27.15 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 118.512 -1.275 . . . . 0.0 113.019 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.3 m -131.88 149.35 32.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.88 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 11.3 t -114.08 139.61 49.16 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 114.238 -1.346 . . . . 0.0 109.12 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 13.3 mt -131.03 138.31 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.118 0 CA-C-O 120.917 0.389 . . . . 0.0 111.015 -173.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.7 t -130.09 128.9 42.8 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.03 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -136.09 129.32 17.95 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.294 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.84 113.65 3.07 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 121.086 1.19 . . . . 0.0 110.61 175.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 50.7 t -81.3 67.41 7.23 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -175.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.425 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.708 177.72 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.061 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -86.91 166.92 14.76 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -50.63 122.04 6.65 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.988 -1.006 . . . . 0.0 112.389 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -103.51 136.73 42.7 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 176.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -120.83 130.89 54.15 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.634 0.73 . . . . 0.0 112.425 -175.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.2 t -94.49 171.82 8.57 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 114.502 -1.226 . . . . 0.0 107.845 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.8 m -92.36 142.67 12.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.042 -178.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.8 t -66.36 132.43 48.32 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.362 -176.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.4 t -93.11 116.35 66.36 Favored Pre-proline 0 C--N 1.311 -1.102 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.509 ' O ' ' HB ' ' A' ' 26' ' ' THR . 19.2 Cg_endo -57.62 -23.96 59.89 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.169 2.579 . . . . 0.0 113.138 -175.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.509 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 55.5 m 83.01 -41.92 0.1 Allowed 'General case' 0 C--O 1.234 0.238 0 C-N-CA 123.209 0.604 . . . . 0.0 111.091 177.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 t 70.41 -146.56 0.08 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.736 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 64.46 51.5 51.73 Favored Glycine 0 CA--C 1.498 -1.029 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -176.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.8 t70 72.92 -57.72 0.62 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.624 0.77 . . . . 0.0 111.146 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 68.1 m -155.21 96.95 1.87 Allowed 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 123.597 0.759 . . . . 0.0 109.043 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.407 ' H ' HD13 ' A' ' 55' ' ' ILE . . . -120.84 145.85 17.39 Favored Glycine 0 N--CA 1.431 -1.682 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.887 -179.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.7 tp -72.39 109.45 6.1 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.71 155.08 52.76 Favored Glycine 0 N--CA 1.438 -1.181 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.14 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.0 p -135.43 152.27 51.22 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.228 0.537 . . . . 0.0 111.306 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -133.49 149.31 51.73 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -130.37 131.11 45.16 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 120.723 0.297 . . . . 0.0 110.917 -178.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -123.07 144.72 15.86 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 109.771 -1.331 . . . . 0.0 109.771 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 28.2 p -134.91 153.94 51.87 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 117.429 0.615 . . . . 0.0 111.65 -177.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.43 ' HG2' ' N ' ' A' ' 40' ' ' THR . 22.6 ttt180 -149.53 161.35 42.3 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.479 ' HA ' ' O ' ' A' ' 45' ' ' LYS . 1.3 p -104.95 154.42 20.12 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 177.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -87.35 -166.53 42.61 Favored Glycine 0 CA--C 1.507 -0.423 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.79 -23.33 58.49 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 118.46 1.13 . . . . 0.0 108.911 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -94.86 7.79 44.81 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.495 -1.23 . . . . 0.0 109.587 176.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.472 ' HA ' ' HB ' ' A' ' 40' ' ' THR . 93.7 m 65.08 30.32 11.67 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.996 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.479 ' O ' ' HA ' ' A' ' 40' ' ' THR . 32.8 mmtp -80.05 -178.34 6.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.668 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -96.2 109.21 21.71 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.976 0.417 . . . . 0.0 111.904 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -109.43 126.38 53.41 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 175.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 27.3 ttt -137.02 153.25 50.69 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -173.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -144.8 135.15 24.27 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.242 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.5 m -116.98 139.04 51.14 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -134.72 152.13 51.52 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.797 0.332 . . . . 0.0 110.6 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.464 ' N ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -105.41 130.91 53.4 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.156 179.249 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 58.1 m -87.91 -168.52 2.24 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 39.3 tttp -124.51 131.47 53.49 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.407 HD13 ' H ' ' A' ' 31' ' ' GLY . 20.1 tt -106.45 118.14 55.36 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 121.014 0.435 . . . . 0.0 110.544 -179.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.28 -29.12 3.27 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.579 2.186 . . . . 0.0 112.91 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 62.1 m . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 122.849 0.459 . . . . 0.0 112.05 179.651 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.786 0 N-CA-C 112.153 -0.379 . . . . 0.0 112.153 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -129.65 -62.03 0.98 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.056 0.455 . . . . 0.0 110.382 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -83.69 -15.14 49.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.589 0.709 . . . . 0.0 109.525 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 9.9 p -153.81 -166.14 2.31 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 114.981 -1.009 . . . . 0.0 108.469 -177.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -132.01 147.36 52.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.499 ' CE2' HD22 ' A' ' 90' ' ' LEU . 48.5 m-85 -118.35 151.55 37.52 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-O 121.18 0.514 . . . . 0.0 111.899 -177.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.447 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 48.8 tp60 -114.76 117.66 31.39 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.033 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -96.58 141.55 29.71 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -119.03 162.39 18.64 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.099 0.476 . . . . 0.0 109.851 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.3 156.76 44.4 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.156 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -103.99 -11.53 17.36 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 165.12 -147.45 12.53 Favored Glycine 0 N--CA 1.428 -1.839 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -117.52 113.87 22.62 Favored 'General case' 0 N--CA 1.427 -1.589 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.869 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 14.9 t 60.77 118.25 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 O-C-N 124.049 0.843 . . . . 0.0 111.633 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -68.82 109.97 4.13 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.9 mt -69.33 -22.29 63.77 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.691 -174.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -66.69 -39.77 88.25 Favored 'General case' 0 N--CA 1.425 -1.675 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.203 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.8 p -107.82 -14.71 14.72 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 69.54 27.17 4.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 122.136 0.97 . . . . 0.0 108.998 -178.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 108' ' ' PRO . 22.6 mt -127.71 167.44 16.45 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-N 114.218 -1.356 . . . . 0.0 107.978 -178.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.536 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 27.7 ttpt -121.84 136.48 54.93 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.762 -177.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.6 m -120.1 145.33 47.0 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 115.175 -0.921 . . . . 0.0 111.565 -175.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -130.32 129.34 43.07 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 176.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.07 138.57 48.55 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.7 152.58 23.14 Favored Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.066 -178.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 23.0 t -145.66 146.02 31.14 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.026 0.441 . . . . 0.0 110.703 -179.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.0 tm? -68.11 123.06 19.61 Favored 'General case' 0 N--CA 1.406 -2.632 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.492 176.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.447 ' HD3' ' HB2' ' A' ' 70' ' ' GLN . 59.6 mtmt -85.75 -48.18 9.05 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 120.905 0.383 . . . . 0.0 110.715 -178.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -161.67 144.44 12.03 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.047 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -132.99 151.78 52.03 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.429 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tp -83.18 169.85 15.35 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -65.5 -27.4 68.45 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.586 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -105.13 45.74 0.95 Allowed 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.555 0.693 . . . . 0.0 109.41 177.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -150.34 115.16 5.28 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.059 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -103.37 117.24 34.03 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.563 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . 0.451 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 83.8 m -141.05 145.9 36.48 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.068 0.461 . . . . 0.0 111.582 -178.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.594 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 20.1 pm0 -66.76 150.08 49.63 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.377 175.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -76.72 -36.53 57.11 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.198 -173.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' THR . . . . . 0.42 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 5.4 t -152.57 149.53 28.58 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 119.296 -0.961 . . . . 0.0 113.378 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 17.0 m -136.39 140.64 43.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.94 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 11.0 t -128.85 136.69 50.81 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.507 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 12.9 tt -140.33 140.69 34.29 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 121.159 0.504 . . . . 0.0 111.249 -178.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 18.6 m -120.43 128.46 53.21 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.018 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -131.32 115.78 16.3 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.394 -179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.401 ' HA ' HD23 ' A' ' 83' ' ' LEU . 77.0 Cg_exo -51.26 127.63 22.73 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.524 2.149 . . . . 0.0 112.078 178.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.536 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 86.0 m -65.68 -50.22 65.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.806 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.224 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.666 179.191 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.75 0 CA-C-O 121.041 0.245 . . . . 0.0 113.067 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.504 ' CD ' ' H ' ' A' ' 17' ' ' GLU . 1.4 pm0 -85.45 170.66 12.46 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 123.791 0.836 . . . . 0.0 111.438 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.508 ' CD2' ' HB2' ' A' ' 39' ' ' ARG . 66.1 m95 -46.77 119.86 2.69 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.692 0.758 . . . . 0.0 112.888 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.44 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 93.5 mt-30 -116.1 115.12 25.5 Favored 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 175.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -101.13 146.55 27.33 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -175.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.0 t -91.98 174.98 7.04 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 114.53 -1.213 . . . . 0.0 109.334 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.9 m -93.13 153.46 3.33 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.325 -175.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.433 ' SG ' ' HD3' ' A' ' 35' ' ' ARG . 34.0 m -84.23 112.04 19.92 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.785 -176.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.467 ' O ' ' HA3' ' A' ' 33' ' ' GLY . 6.9 m -106.86 102.76 44.15 Favored Pre-proline 0 N--CA 1.435 -1.201 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 174.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.558 ' O ' ' HB ' ' A' ' 26' ' ' THR . 26.3 Cg_endo -62.18 -16.55 51.43 Favored 'Trans proline' 0 C--O 1.218 -0.484 0 C-N-CA 122.839 2.359 . . . . 0.0 112.553 -176.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.558 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 51.9 m 81.62 -14.53 0.79 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 122.544 1.164 . . . . 0.0 108.875 177.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.491 ' H ' ' C ' ' A' ' 25' ' ' PRO . 16.7 t -142.37 -145.46 0.17 Allowed 'General case' 0 N--CA 1.411 -2.414 0 CA-C-N 113.767 -1.561 . . . . 0.0 109.113 -178.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -151.93 -42.25 0.02 OUTLIER Glycine 0 CA--C 1.482 -2.023 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -102.98 66.54 0.92 Allowed 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.38 0.61 . . . . 0.0 110.797 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.2 m 75.29 76.43 0.1 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.463 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.463 ' O ' HD11 ' A' ' 55' ' ' ILE . . . -127.89 154.94 19.98 Favored Glycine 0 N--CA 1.44 -1.04 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 177.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.45 HD21 HH11 ' A' ' 52' ' ' ARG . 55.7 tp -83.76 125.42 31.89 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.739 0.269 . . . . 0.0 110.893 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.467 ' HA3' ' O ' ' A' ' 24' ' ' VAL . . . -139.17 164.74 25.83 Favored Glycine 0 CA--C 1.505 -0.564 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 -177.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 6.8 m -145.69 154.92 42.62 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -174.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.433 ' HD3' ' SG ' ' A' ' 23' ' ' CYS . 23.5 ptt180 -134.9 154.32 51.72 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.759 176.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -115.96 131.72 56.86 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.148 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -122.46 151.07 16.89 Favored Glycine 0 CA--C 1.52 0.357 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.506 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 14.2 p -134.32 155.03 50.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.429 0.614 . . . . 0.0 111.471 -177.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.525 ' HG2' ' N ' ' A' ' 40' ' ' THR . 17.5 ttt180 -151.49 160.47 43.69 Favored 'General case' 0 C--O 1.217 -0.609 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.525 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -133.71 155.34 49.92 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 174.908 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -106.39 -152.11 19.35 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 111.095 -0.802 . . . . 0.0 111.095 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.58 -33.63 53.86 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 117.062 0.431 . . . . 0.0 111.649 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -84.94 1.68 46.25 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -177.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.452 ' HA ' HG21 ' A' ' 40' ' ' THR . 66.4 m 57.78 32.87 22.52 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.873 0.368 . . . . 0.0 111.422 -178.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -68.36 -23.54 64.7 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.312 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 72.25 105.46 0.07 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.635 0.731 . . . . 0.0 112.278 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 m -105.15 145.11 31.02 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.269 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 26.0 ttt -139.54 148.25 42.34 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.555 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -143.35 136.34 27.78 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.0 p -116.62 135.9 53.41 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 55.7 tp60 -137.86 138.24 38.9 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 120.364 -0.535 . . . . 0.0 111.386 -177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.45 HH11 HD21 ' A' ' 32' ' ' LEU . 39.6 mtt180 -87.37 131.5 34.26 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 85.4 m -82.36 160.64 22.77 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -113.69 135.38 54.0 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-O 121.259 0.552 . . . . 0.0 112.113 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.463 HD11 ' O ' ' A' ' 31' ' ' GLY . 4.0 mp -111.16 126.22 29.08 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.751 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -70.08 103.18 1.18 Allowed 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.487 2.125 . . . . 0.0 111.349 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 4.6 t . . . . . 0 C--N 1.316 -0.89 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.213 -177.977 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.891 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.5 -32.88 74.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.625 0.25 . . . . 0.0 111.625 -178.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -84.76 -13.4 51.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.968 0.413 . . . . 0.0 111.027 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 82.0 m -81.91 158.86 23.8 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.693 ' O ' ' HA ' ' A' ' 90' ' ' LEU . 47.6 mtpt -128.19 127.68 43.37 Favored 'General case' 0 CA--C 1.498 -1.025 0 C-N-CA 119.631 -0.828 . . . . 0.0 110.896 -176.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.427 ' CE2' ' HB2' ' A' ' 100' ' ' GLN . 79.0 m-85 -124.8 129.33 50.24 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.894 -175.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -112.07 129.75 56.11 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -94.14 135.7 35.24 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.979 0.419 . . . . 0.0 110.924 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.412 HE21 ' HB ' ' A' ' 87' ' ' THR . 7.1 pt20 -108.19 162.97 13.58 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.916 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.65 92.27 3.22 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.713 -177.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 43.0 p-90 -92.45 -18.07 23.71 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.525 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -167.27 110.77 0.41 Allowed Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.991 -0.843 . . . . 0.0 110.991 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -95.53 115.84 28.0 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-O 120.792 0.329 . . . . 0.0 111.774 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.553 ' H ' ' HG3' ' A' ' 84' ' ' LYS . 13.5 t 60.76 107.72 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.744 -1.116 . . . . 0.0 112.428 175.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.545 ' OD2' HG22 ' A' ' 81' ' ' THR . 27.3 t70 -82.16 131.16 35.24 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.789 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.8 mt -72.39 -32.41 66.37 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.559 -176.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -69.13 -42.42 76.04 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.288 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.57 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 10.0 t -105.99 -1.61 23.79 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -175.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 55.06 32.47 18.32 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 81' ' ' THR . 24.0 mt -127.1 164.33 21.82 Favored 'General case' 0 CA--C 1.497 -1.081 0 O-C-N 121.845 -0.535 . . . . 0.0 110.143 -178.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.553 ' HG3' ' H ' ' A' ' 77' ' ' CYS . 77.5 tttt -120.64 136.68 54.76 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -177.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 4.2 m -119.35 144.24 46.97 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.567 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -139.48 141.19 37.4 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.089 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.412 ' HB ' HE21 ' A' ' 72' ' ' GLN . 14.2 m -120.93 145.5 47.63 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.091 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -144.55 157.16 27.14 Favored Glycine 0 N--CA 1.443 -0.849 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.9 m -145.61 149.64 34.89 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.62 0.21 . . . . 0.0 111.206 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.693 ' HA ' ' O ' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -69.46 129.97 41.2 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.003 0.43 . . . . 0.0 110.219 177.595 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -92.65 -32.72 14.65 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 120.906 0.384 . . . . 0.0 110.91 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.94 143.93 31.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -134.65 145.46 48.6 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.71 0.291 . . . . 0.0 110.822 -176.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.7 mp -91.4 174.73 7.22 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.233 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -88.95 -17.25 29.88 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.105 0.478 . . . . 0.0 110.833 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -101.86 28.03 6.03 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.274 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -164.01 117.79 1.47 Allowed 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.983 -176.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -82.03 111.27 18.03 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 174.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 80.4 m -94.3 165.21 12.7 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.37 0.605 . . . . 0.0 112.262 -175.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' A' ' 90' ' ' LEU . 88.4 mt-30 -87.04 124.62 33.41 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.251 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.531 ' HA ' HD11 ' A' ' 90' ' ' LEU . 20.1 pttm -74.79 -31.96 61.88 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.412 -178.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.9 t -158.88 149.22 19.63 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-O 121.463 0.649 . . . . 0.0 111.389 175.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 13.7 m -141.5 139.47 32.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.063 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.5 m -129.04 131.67 47.38 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.108 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 22.4 pt -135.47 145.63 31.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 CA-C-O 120.625 0.25 . . . . 0.0 110.453 -177.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 84' ' ' LYS . 6.5 p -122.55 134.38 54.54 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.872 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -126.03 132.32 24.27 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.888 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.44 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 30.8 Cg_endo -64.03 124.47 13.56 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.049 1.833 . . . . 0.0 112.233 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 94.9 m -73.12 -17.85 61.35 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.235 0.541 . . . . 0.0 109.822 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.536 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 178.083 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.031 0 N-CA-C 112.034 -0.426 . . . . 0.0 112.034 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -107.83 164.55 12.15 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -56.98 123.55 15.54 Favored 'General case' 0 N--CA 1.427 -1.592 0 O-C-N 123.528 0.518 . . . . 0.0 111.109 173.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.556 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 74.3 mt-30 -115.95 115.45 26.19 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -104.26 143.61 32.73 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 t -104.38 171.59 7.25 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.87 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.8 m -94.61 154.82 3.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.6 t -56.16 114.15 1.84 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.325 -178.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 10.5 m -109.99 120.81 43.63 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.989 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.97 129.58 19.87 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 122.786 2.324 . . . . 0.0 113.731 -177.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.514 ' HB ' ' O ' ' A' ' 32' ' ' LEU . 94.9 m -77.75 -22.51 50.17 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.227 176.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.558 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 17.9 t -159.71 116.91 2.62 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.65 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.9 -32.73 80.79 Favored Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.746 -0.661 . . . . 0.0 113.088 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -76.38 52.68 0.79 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.566 0.222 . . . . 0.0 111.371 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.419 ' HA ' HD12 ' A' ' 55' ' ' ILE . 42.5 t 65.95 80.98 0.21 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.141 179.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.558 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -148.87 157.11 27.14 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.3 -0.952 . . . . 0.0 114.191 -177.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.514 ' O ' ' HB ' ' A' ' 26' ' ' THR . 4.3 mm? -49.26 158.42 0.38 Allowed 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 124.465 1.106 . . . . 0.0 112.459 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.1 176.71 19.85 Favored Glycine 0 N--CA 1.434 -1.496 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -178.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.4 p -140.35 156.19 46.51 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 118.24 1.02 . . . . 0.0 113.049 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 70.9 mtt-85 -135.62 138.47 42.94 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.749 -1.114 . . . . 0.0 108.542 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -124.85 131.31 53.45 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 120.858 0.361 . . . . 0.0 111.583 -177.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.556 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -133.42 137.33 9.27 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.6 p -132.04 152.8 50.96 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 117.439 0.619 . . . . 0.0 111.083 -177.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.4 ' HG2' ' N ' ' A' ' 40' ' ' THR . 68.7 ttt180 -155.17 160.77 41.16 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.4 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 6.2 p -117.88 161.85 19.08 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -81.11 -173.03 47.15 Favored Glycine 0 C--N 1.322 -0.248 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.222 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.79 -33.47 72.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.983 0.42 . . . . 0.0 110.983 -178.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -97.7 18.12 16.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.497 0.665 . . . . 0.0 109.414 176.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 72.4 m 69.06 60.04 0.34 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.954 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HG3' ' H ' ' A' ' 46' ' ' GLN . 14.4 tptm -77.6 -145.87 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.814 176.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.412 ' H ' ' HG3' ' A' ' 45' ' ' LYS . 52.2 tt0 -150.1 116.09 5.64 Favored 'General case' 0 N--CA 1.412 -2.342 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 -178.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.0 m -133.47 122.18 23.28 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 57.0 mtm -129.0 134.97 48.36 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.912 0.387 . . . . 0.0 111.114 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -132.25 130.33 40.79 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.541 177.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 p -130.8 131.3 44.58 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 176.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -124.93 141.97 51.77 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 121.105 0.478 . . . . 0.0 110.231 -176.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -85.45 110.72 19.37 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 122.451 1.12 . . . . 0.0 112.232 -177.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.2 t -68.66 147.23 52.18 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 113.063 -1.88 . . . . 0.0 109.867 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.0 tttm -114.07 142.14 46.57 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-O 120.753 0.311 . . . . 0.0 110.552 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.419 HD12 ' HA ' ' A' ' 30' ' ' CYS . 17.9 tt -97.91 130.89 27.76 Favored Pre-proline 0 C--N 1.308 -1.197 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -51.0 -52.65 8.64 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.974 2.449 . . . . 0.0 112.242 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 6.3 t . . . . . 0 CA--C 1.536 0.44 0 O-C-N 123.764 0.665 . . . . 0.0 110.886 179.435 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.455 0 N-CA-C 112.634 -0.186 . . . . 0.0 112.634 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 62.55 15.69 8.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.047 0.539 . . . . 0.0 111.719 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -84.25 -5.63 59.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.363 0.601 . . . . 0.0 110.293 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 50.0 m -136.52 -160.68 1.08 Allowed 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -127.11 137.05 52.92 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.047 0.385 . . . . 0.0 110.134 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.404 ' HE2' ' HB2' ' A' ' 90' ' ' LEU . 12.5 m-85 -123.26 150.24 43.75 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.995 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.9 tm0? -125.51 125.43 43.25 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -94.18 131.43 39.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.199 0.523 . . . . 0.0 112.141 -176.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -97.25 163.79 12.76 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.84 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -126.66 79.32 1.86 Allowed 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.109 -178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 42.2 t-105 -82.32 -26.31 33.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.238 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -143.78 157.14 26.95 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.574 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -96.32 147.92 23.3 Favored 'General case' 0 N--CA 1.437 -1.113 0 C-N-CA 123.167 0.587 . . . . 0.0 110.15 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 40.5 t -30.63 137.38 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 O-C-N 124.203 0.939 . . . . 0.0 111.428 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -77.85 122.04 24.92 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 121.516 0.674 . . . . 0.0 109.841 -176.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.8 mt -70.7 -33.12 70.55 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 114.609 -1.178 . . . . 0.0 112.091 -173.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -71.67 -37.49 70.76 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.496 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.513 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 68.1 p -104.32 -8.01 19.57 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -172.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 57.27 34.5 24.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.275 0.56 . . . . 0.0 110.528 -175.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 81' ' ' THR . 44.1 mt -126.98 147.3 50.12 Favored 'General case' 0 CA--C 1.496 -1.11 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.094 -178.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.737 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 81.4 tttt -124.77 137.26 54.33 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.703 -178.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 52.3 m -119.12 143.76 47.0 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 -134.73 140.55 46.03 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.0 m -109.81 143.72 39.26 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -136.39 167.28 24.52 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 120.462 -0.875 . . . . 0.0 111.393 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.8 p -135.22 144.28 46.83 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 120.626 0.25 . . . . 0.0 110.7 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.577 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 2.9 tm? -70.76 122.87 20.66 Favored 'General case' 0 N--CA 1.409 -2.492 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -97.35 -37.54 9.99 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.957 0.408 . . . . 0.0 110.853 -177.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -155.64 135.06 12.4 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.234 178.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -126.18 144.78 50.63 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 42.9 mt -87.24 174.39 8.62 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.394 0.616 . . . . 0.0 111.535 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -73.64 -26.7 60.89 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.48 -178.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -105.05 35.94 2.64 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.613 0.72 . . . . 0.0 109.495 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -154.11 134.57 13.47 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.921 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -112.31 122.46 47.79 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 70.7 m -139.72 141.31 36.92 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.205 0.526 . . . . 0.0 111.599 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.577 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 3.0 pm0 -68.72 154.27 42.26 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.81 176.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.4 pttm -74.07 -26.55 60.45 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.555 -175.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.5 t -140.63 150.95 44.2 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.324 -0.55 . . . . 0.0 111.665 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 15.8 m -138.87 149.48 23.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.24 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 97.2 m -129.24 136.61 50.33 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.42 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tt -140.7 141.31 32.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 120.84 0.352 . . . . 0.0 110.614 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 57.6 m -121.16 134.8 55.23 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -134.27 133.94 22.24 Favored Pre-proline 0 C--N 1.313 -0.983 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.429 -178.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.446 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 32.7 Cg_exo -58.12 131.03 40.93 Favored 'Trans proline' 0 C--O 1.244 0.777 0 C-N-CA 121.924 1.75 . . . . 0.0 111.504 175.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.737 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 69.8 m -81.77 173.55 12.18 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.325 0.583 . . . . 0.0 111.576 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.151 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 -179.561 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.755 0 CA-C-O 120.855 0.142 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -76.2 169.66 17.79 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 122.93 0.492 . . . . 0.0 111.253 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.51 ' CD2' ' HB2' ' A' ' 39' ' ' ARG . 81.6 m95 -48.57 118.93 2.75 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.417 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.438 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 6.8 pt20 -120.14 115.44 23.66 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 89.7 m95 -100.8 146.41 27.32 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.803 -175.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 m -94.53 171.8 8.58 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 114.79 -1.095 . . . . 0.0 108.998 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.5 m -91.93 154.79 3.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -177.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.8 t -74.45 116.47 15.16 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.805 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.0 t -111.44 117.87 48.39 Favored Pre-proline 0 N--CA 1.434 -1.246 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 179.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.32 143.66 75.26 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.533 2.155 . . . . 0.0 112.373 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.485 ' HB ' ' O ' ' A' ' 32' ' ' LEU . 23.7 m -90.3 -23.8 21.06 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.354 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.4 t -134.62 173.63 11.45 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.074 179.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.94 74.57 0.25 Allowed Glycine 0 N--CA 1.448 -0.565 0 O-C-N 123.683 0.614 . . . . 0.0 113.617 -177.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.7 t70 68.93 23.87 6.56 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-O 121.9 0.857 . . . . 0.0 110.826 174.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.488 ' HA ' ' HB2' ' A' ' 57' ' ' CYS . 9.0 t -150.92 10.35 0.61 Allowed 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.619 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.473 ' O ' HG13 ' A' ' 55' ' ' ILE . . . -126.51 126.1 5.62 Favored Glycine 0 CA--C 1.494 -1.229 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.539 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.485 ' O ' ' HB ' ' A' ' 26' ' ' THR . 1.2 mp -51.64 152.4 2.81 Favored 'General case' 0 C--O 1.207 -1.158 0 O-C-N 124.176 0.574 . . . . 0.0 111.483 -179.028 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.07 -175.19 14.79 Favored Glycine 0 CA--C 1.496 -1.154 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 -173.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.2 p -136.8 154.14 50.62 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 117.816 0.808 . . . . 0.0 112.207 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -126.23 137.63 53.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 175.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -113.9 131.41 56.3 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.569 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.438 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -137.7 141.7 12.51 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.487 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 22.8 p -123.79 154.78 39.06 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.954 0.377 . . . . 0.0 110.658 -179.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.51 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 9.4 tpt180 -145.18 159.95 42.21 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.412 ' N ' ' HG3' ' A' ' 39' ' ' ARG . 11.1 t -115.84 162.22 17.63 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-O 122.173 0.987 . . . . 0.0 112.225 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.41 -164.15 11.23 Favored Glycine 0 C--N 1.286 -2.24 0 CA-C-N 113.432 -1.713 . . . . 0.0 108.839 175.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.17 -25.97 66.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 118.254 1.027 . . . . 0.0 111.872 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -99.73 -11.34 20.94 Favored 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 120.182 -0.607 . . . . 0.0 111.364 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.404 ' HA ' ' OG1' ' A' ' 40' ' ' THR . 93.8 m 68.29 152.17 0.09 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptp 63.25 10.8 4.9 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.832 175.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -103.57 18.12 22.57 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.408 ' HB ' ' O ' ' A' ' 39' ' ' ARG . 11.9 m -143.62 110.44 5.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.549 0.69 . . . . 0.0 112.01 178.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 24.2 ttt -146.23 135.11 22.46 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.045 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -143.05 142.76 31.64 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.12 0.486 . . . . 0.0 111.397 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.1 m -118.4 136.58 53.68 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.08 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -128.73 141.19 51.4 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 110.264 -0.272 . . . . 0.0 110.264 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 84.1 mtt180 -86.91 139.49 30.58 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.434 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 1.5 p -99.96 -170.18 1.85 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -113.49 138.42 50.15 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.655 0.264 . . . . 0.0 110.75 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 31' ' ' GLY . 22.0 mm -126.69 111.15 22.63 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.273 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.76 122.92 9.59 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.569 2.179 . . . . 0.0 111.411 177.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.488 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 42.6 t . . . . . 0 C--N 1.322 -0.604 0 CA-C-O 120.663 0.268 . . . . 0.0 110.986 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.727 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.06 -56.89 2.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.017 0.436 . . . . 0.0 110.596 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -89.17 -19.72 25.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.879 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 99.0 m -80.72 116.52 20.77 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.539 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -112.98 130.33 56.17 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.681 ' CE1' HD21 ' A' ' 90' ' ' LEU . 4.6 m-85 -106.58 152.36 23.82 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.374 -177.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.433 ' O ' ' HA2' ' A' ' 88' ' ' GLY . 6.4 tp-100 -103.34 117.05 33.61 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 174.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -94.52 118.74 32.14 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -175.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -122.34 162.97 20.55 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.373 177.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.52 141.63 28.47 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-O 120.972 0.415 . . . . 0.0 111.037 -176.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 40.6 t-105 -97.65 -5.3 35.67 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 148.85 -170.57 29.25 Favored Glycine 0 N--CA 1.427 -1.94 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.873 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -95.68 148.48 22.5 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 124.04 0.936 . . . . 0.0 109.09 179.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 13.8 m -22.98 125.18 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.358 0 O-C-N 124.225 0.953 . . . . 0.0 112.447 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -80.33 120.46 24.41 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.1 mt -70.22 -28.33 65.18 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.304 -0.862 . . . . 0.0 112.302 -174.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -70.7 -37.38 73.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.029 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.606 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.5 p -105.37 -9.41 17.59 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -174.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.98 25.72 14.16 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.422 0.689 . . . . 0.0 110.972 -175.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 81' ' ' THR . 13.9 mt -126.86 162.41 25.95 Favored 'General case' 0 CA--C 1.5 -0.968 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.49 -177.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.614 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 34.9 ttpt -118.93 147.84 43.59 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.1 m -119.27 142.48 48.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.841 0.353 . . . . 0.0 110.479 -176.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.0 tpt180 -135.22 141.03 45.73 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -178.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.7 m -118.43 144.69 45.78 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.486 -178.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.433 ' HA2' ' O ' ' A' ' 70' ' ' GLN . . . -136.29 150.28 20.4 Favored Glycine 0 N--CA 1.435 -1.379 0 C-N-CA 120.195 -1.002 . . . . 0.0 111.938 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 25.8 m -127.36 134.29 49.97 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 120.981 0.419 . . . . 0.0 111.903 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.681 HD21 ' CE1' ' A' ' 69' ' ' TYR . 2.8 tm? -74.4 127.49 33.16 Favored 'General case' 0 N--CA 1.427 -1.62 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.235 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -86.77 -50.75 6.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.567 -177.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -144.08 142.02 30.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.83 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.402 ' HB3' HD12 ' A' ' 90' ' ' LEU . . . -135.18 140.02 45.02 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.7 mp -89.12 175.92 7.18 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 120.915 0.388 . . . . 0.0 110.582 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -83.23 0.52 45.16 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.909 0.385 . . . . 0.0 111.578 -176.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -101.19 15.14 29.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.162 0.506 . . . . 0.0 110.339 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -173.9 123.64 0.34 Allowed 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.04 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -93.58 110.14 21.75 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.331 0.586 . . . . 0.0 109.654 177.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 75.7 m -109.91 133.05 53.59 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.114 -177.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -66.96 150.81 48.71 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.01 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -74.82 -29.63 61.13 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.939 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.7 t -146.05 150.06 35.27 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.766 0.793 . . . . 0.0 112.263 178.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 28.7 m -135.49 146.87 29.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.316 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 95.8 m -128.43 127.68 43.0 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 13.5 tt -136.02 148.62 27.65 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 CA-C-O 120.818 0.342 . . . . 0.0 110.611 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.4 ' HA ' ' O ' ' A' ' 84' ' ' LYS . 54.6 m -130.3 135.68 48.34 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.097 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -133.26 148.59 69.68 Favored Pre-proline 0 C--N 1.319 -0.745 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.876 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . 0.514 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 34.4 Cg_exo -59.63 131.98 43.16 Favored 'Trans proline' 0 CA--C 1.516 -0.408 0 C-N-CA 122.63 2.22 . . . . 0.0 113.022 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.614 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 78.8 m -75.31 -17.02 60.37 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.349 0.595 . . . . 0.0 109.938 176.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.105 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 177.022 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.997 0 CA-C-O 121.392 0.44 . . . . 0.0 114.115 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -73.97 167.95 20.48 Favored 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 123.915 0.886 . . . . 0.0 111.816 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -49.4 125.14 10.52 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 114.648 -1.16 . . . . 0.0 112.159 178.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -115.5 123.06 47.57 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -102.83 133.11 48.45 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.167 0.508 . . . . 0.0 111.781 -175.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.9 p -96.11 170.09 9.51 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.654 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.3 m -87.23 131.01 36.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 122.494 1.14 . . . . 0.0 111.555 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.473 ' HB2' ' HB2' ' A' ' 35' ' ' ARG . 50.9 t -81.15 135.85 35.83 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 112.947 -1.933 . . . . 0.0 112.779 -175.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.478 ' O ' ' HA3' ' A' ' 33' ' ' GLY . 57.5 t -100.44 100.65 12.59 Favored Pre-proline 0 N--CA 1.438 -1.054 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 171.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.567 ' O ' ' HB ' ' A' ' 26' ' ' THR . 72.3 Cg_endo -74.89 0.92 8.25 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.782 2.321 . . . . 0.0 113.361 -174.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.567 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 17.0 m 80.9 -39.09 0.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.794 0.438 . . . . 0.0 110.611 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.1 t 75.21 179.56 0.19 Allowed 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.616 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.21 8.05 48.15 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.023 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 64.09 10.01 5.1 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.428 0.691 . . . . 0.0 111.577 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 59.2 m -159.14 30.55 0.21 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -109.14 140.11 15.52 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 119.898 -1.144 . . . . 0.0 113.443 -174.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 53' ' ' CYS . 47.6 tp -100.52 127.04 47.0 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 176.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' A' ' 24' ' ' VAL . . . -126.7 -173.49 13.55 Favored Glycine 0 C--N 1.316 -0.544 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 p -137.02 153.32 50.67 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 118.893 1.346 . . . . 0.0 112.986 -178.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.473 ' HB2' ' HB2' ' A' ' 23' ' ' CYS . 45.3 ttm180 -131.57 137.91 48.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.614 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -115.35 130.41 56.89 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 120.679 0.276 . . . . 0.0 111.029 -178.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -127.88 135.71 8.82 Favored Glycine 0 N--CA 1.435 -1.405 0 N-CA-C 109.038 -1.625 . . . . 0.0 109.038 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 29.8 m -129.06 148.48 51.01 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 117.964 0.882 . . . . 0.0 110.361 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -142.63 162.03 36.53 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.78 145.21 33.03 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -101.65 -158.52 26.73 Favored Glycine 0 N--CA 1.437 -1.235 0 C-N-CA 120.069 -1.062 . . . . 0.0 112.155 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.18 -31.54 72.01 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.15 0.5 . . . . 0.0 110.325 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 27.9 mm-40 -89.49 2.45 54.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.831 178.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 35.89 59.37 0.88 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -174.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 74.5 mmtt -128.62 143.43 50.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.884 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.514 ' HG3' ' H ' ' A' ' 47' ' ' THR . 18.7 pt20 36.02 -108.7 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.575 1.15 . . . . 0.0 113.886 -178.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.514 ' H ' ' HG3' ' A' ' 46' ' ' GLN . 3.0 p 46.35 45.59 13.4 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.891 0.876 . . . . 0.0 113.189 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -125.48 138.34 53.99 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.808 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -136.18 143.75 44.6 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 121.011 0.434 . . . . 0.0 110.385 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 16.6 p -117.65 137.46 52.63 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 66.5 mm-40 -122.24 151.81 40.67 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -177.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.8 mtm180 -107.92 126.98 53.33 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.465 ' O ' HD13 ' A' ' 32' ' ' LEU . 36.3 m -88.32 125.23 34.58 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -111.85 138.87 47.87 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 121.124 0.488 . . . . 0.0 112.041 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.1 mm -114.19 106.05 53.43 Favored Pre-proline 0 N--CA 1.436 -1.148 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -64.67 100.44 0.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.187 1.924 . . . . 0.0 111.358 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.8 t . . . . . 0 C--N 1.32 -0.71 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.897 -178.261 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.566 ' HA3' ' CG ' ' A' ' 69' ' ' TYR . . . . . . . . 0 N--CA 1.449 -0.498 0 N-CA-C 112.643 -0.183 . . . . 0.0 112.643 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.71 -13.51 48.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 0.0 110.743 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -88.96 -5.26 58.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.397 0.618 . . . . 0.0 109.706 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 10.1 p -147.44 -118.08 0.07 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.703 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 92' ' ' ARG . 62.9 mttp -133.38 125.9 30.13 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 122.204 -0.31 . . . . 0.0 110.453 178.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.566 ' CG ' ' HA3' ' A' ' 64' ' ' GLY . 0.3 OUTLIER -130.94 152.9 49.76 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.174 0.511 . . . . 0.0 111.877 -175.997 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -103.27 118.43 36.76 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.22 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -97.6 114.62 26.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -175.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.434 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 6.6 tt0 -123.63 136.83 54.72 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.636 175.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 57.08 36.32 27.5 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.545 0.688 . . . . 0.0 111.179 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -86.62 -23.9 25.54 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.718 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.03 -88.36 0.08 OUTLIER Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 116.054 1.181 . . . . 0.0 116.054 -175.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -117.47 143.88 45.59 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -169.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 8.4 t -69.8 159.32 33.81 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.759 175.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -94.32 115.91 28.2 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-O 121.354 0.597 . . . . 0.0 111.108 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -71.16 -30.61 66.66 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.958 -178.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -66.9 -33.26 75.2 Favored 'General case' 0 CA--C 1.496 -1.113 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.165 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.499 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 67.8 p -107.72 -8.33 16.11 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.045 -177.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.435 ' O ' HD21 ' A' ' 83' ' ' LEU . . . 59.1 38.3 23.91 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.419 -175.136 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 81' ' ' THR . 81.0 mt -130.02 148.84 51.92 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.488 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.751 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 60.6 tttp -127.05 135.53 50.92 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.649 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -139.37 145.78 39.41 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.71 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -136.44 130.06 32.08 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.896 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' THR . . . . . 0.434 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 4.0 m -120.87 143.69 48.78 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.309 -179.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -149.84 152.34 24.28 Favored Glycine 0 N--CA 1.436 -1.356 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.899 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.8 m -146.12 144.19 29.83 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.379 -0.411 . . . . 0.0 111.58 177.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.654 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 4.9 tt -72.26 122.45 21.12 Favored 'General case' 0 N--CA 1.432 -1.365 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 176.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.463 ' HE2' ' O ' ' A' ' 69' ' ' TYR . 46.1 pttt -104.93 -12.58 16.15 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -178.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.519 ' HB2' ' HB2' ' A' ' 68' ' ' LYS . 21.2 mmt180 -150.94 134.19 16.12 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -111.17 132.64 54.15 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.411 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.413 ' HB2' ' HB2' ' A' ' 97' ' ' ALA . 10.3 mp -94.47 152.61 18.44 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.004 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -76.82 -10.37 59.33 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.95 0.405 . . . . 0.0 111.288 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -125.07 19.93 8.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.281 0.563 . . . . 0.0 111.05 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.413 ' HB2' ' HB2' ' A' ' 94' ' ' LEU . . . -156.23 112.25 3.03 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.701 -178.068 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -91.32 110.97 22.27 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . 0.438 ' HB2' ' CD1' ' A' ' 90' ' ' LEU . 91.2 m -101.53 162.64 12.75 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.65 0.738 . . . . 0.0 112.863 -177.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.654 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 3.1 pt20 -66.77 130.49 43.35 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.075 -1.421 . . . . 0.0 108.91 176.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.455 ' HA ' ' HB3' ' A' ' 90' ' ' LEU . 29.0 tptp -76.72 -44.97 31.24 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.173 -174.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.9 t -151.34 153.05 34.03 Favored 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 119.862 -0.735 . . . . 0.0 111.689 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 m -143.71 136.7 24.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.953 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 89.2 m -130.83 124.25 30.87 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.423 175.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.3 tt -140.6 136.56 35.72 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 CA-C-O 121.453 0.644 . . . . 0.0 111.323 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.8 m -126.56 131.37 51.56 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.44 178.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -133.59 106.99 11.89 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.815 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.12 125.01 16.99 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.33 2.02 . . . . 0.0 111.829 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.751 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 86.8 m -85.52 -178.04 6.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.549 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.112 0 N-CA-C 111.127 -0.789 . . . . 0.0 111.127 178.094 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.407 0 CA-C-O 120.909 0.172 . . . . 0.0 113.192 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 19' ' ' GLN . 42.0 mm-40 -74.86 169.17 18.46 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.028 0.531 . . . . 0.0 111.737 -178.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.578 ' CD2' ' HB2' ' A' ' 39' ' ' ARG . 94.7 m95 -48.27 119.48 3.0 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.066 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 28.2 mt-30 -108.83 115.73 30.64 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 177.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -105.26 145.12 31.1 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-O 121.686 0.755 . . . . 0.0 112.95 -174.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -93.64 175.23 6.82 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.89 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.3 m -94.2 129.18 44.84 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -176.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.75 96.05 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.396 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -102.03 101.04 16.73 Favored Pre-proline 0 N--CA 1.439 -1.01 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.663 ' O ' ' HB ' ' A' ' 26' ' ' THR . 56.9 Cg_endo -71.98 -20.78 25.12 Favored 'Trans proline' 0 C--O 1.207 -1.07 0 C-N-CA 122.277 1.984 . . . . 0.0 111.068 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.663 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 7.8 m 107.41 -32.47 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.948 1.299 . . . . 0.0 110.155 177.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.9 t 75.51 -162.32 0.06 Allowed 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.482 175.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.97 -93.62 1.05 Allowed Glycine 0 CA--C 1.49 -1.53 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -175.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.463 ' O ' ' HB2' ' A' ' 30' ' ' CYS . 9.8 p-10 -160.13 58.93 0.35 Allowed 'General case' 0 C--N 1.284 -2.271 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 177.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 29' ' ' ASP . 83.3 m 83.14 97.41 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 112.717 -2.038 . . . . 0.0 110.135 -176.071 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -127.3 156.45 20.39 Favored Glycine 0 N--CA 1.434 -1.484 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.826 -178.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.5 tp -80.95 131.39 35.33 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.947 0.374 . . . . 0.0 110.29 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.82 173.93 22.63 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 -176.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 p -143.55 160.14 41.16 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -174.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -137.41 137.15 38.5 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.927 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.12 132.44 56.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.722 -0.217 . . . . 0.0 111.145 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -133.02 128.29 5.05 Favored Glycine 0 N--CA 1.445 -0.752 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 176.141 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 66.5 p -130.99 146.9 52.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 117.532 0.666 . . . . 0.0 110.65 -176.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.578 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 6.7 ttp85 -143.83 155.51 44.15 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.489 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 0.7 OUTLIER -149.44 144.0 26.06 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-O 120.781 0.324 . . . . 0.0 110.172 176.928 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.89 -173.48 49.41 Favored Glycine 0 CA--C 1.499 -0.925 0 N-CA-C 110.275 -1.13 . . . . 0.0 110.275 176.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.61 -30.91 69.02 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.342 0.591 . . . . 0.0 109.998 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -89.17 6.33 40.58 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.76 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 10.1 m 46.95 79.63 0.06 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.575 0.702 . . . . 0.0 112.589 -175.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.7 tptt -82.75 2.83 31.95 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.901 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.438 ' H ' HG22 ' A' ' 40' ' ' THR . 93.4 mt-30 48.67 56.27 7.85 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.915 -178.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 m -89.72 102.75 15.44 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.135 0.493 . . . . 0.0 109.937 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 20.5 ptp -136.7 146.29 45.7 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-O 121.078 0.466 . . . . 0.0 111.902 -176.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.424 ' HA ' ' HE3' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -143.04 143.27 31.82 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.484 179.535 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 18.7 m -115.82 138.16 51.41 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.143 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -133.4 146.44 51.22 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.183 0.516 . . . . 0.0 111.518 -175.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -85.0 137.36 33.12 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 176.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.0 t -91.21 154.51 19.25 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 -177.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -112.85 138.87 49.04 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.219 0.533 . . . . 0.0 111.2 -176.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 4.9 tp -118.38 112.79 37.29 Favored Pre-proline 0 C--N 1.319 -0.729 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.888 -178.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.39 106.54 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.668 2.245 . . . . 0.0 112.079 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 79.7 m . . . . . 0 C--N 1.317 -0.807 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.146 -179.246 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.911 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -112.56 -62.95 1.5 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.937 0.398 . . . . 0.0 110.426 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.11 -5.51 25.58 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.535 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.433 ' SG ' HD22 ' A' ' 90' ' ' LEU . 11.8 t -76.78 167.82 21.16 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 176.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.409 ' O ' HD21 ' A' ' 90' ' ' LEU . 56.3 mttp -125.08 125.58 44.01 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.018 -177.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.537 ' HH ' ' HG2' ' A' ' 100' ' ' GLN . 0.1 OUTLIER -124.56 153.56 41.95 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.802 -178.424 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -100.81 140.22 35.4 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.217 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -96.31 139.76 31.98 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.743 0.817 . . . . 0.0 109.008 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.408 HE21 ' HB3' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -77.97 164.76 24.81 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.75 28.97 1.25 Allowed 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -176.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 48.8 t-105 -87.31 -14.03 41.98 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.794 -175.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 108.11 127.07 5.56 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 119.884 -1.151 . . . . 0.0 111.075 -175.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -105.46 134.11 49.12 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-O 120.763 0.315 . . . . 0.0 111.547 -178.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 52.7 t 68.12 104.29 0.05 Allowed 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.809 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.462 ' HB2' ' OG1' ' A' ' 81' ' ' THR . 20.6 m-20 -87.49 112.06 21.81 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 177.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.38 -30.22 68.16 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.795 -175.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -67.83 -29.93 69.21 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.254 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.568 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.5 p -104.45 -8.23 19.27 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.566 -0.453 . . . . 0.0 111.163 -177.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.449 ' O ' HD21 ' A' ' 83' ' ' LEU . . . 59.67 30.39 20.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.512 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 81' ' ' THR . 67.3 mt -129.06 160.37 33.0 Favored 'General case' 0 CA--C 1.498 -1.032 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.204 -175.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.46 ' HB2' ' HB2' ' A' ' 109' ' ' CYS . 35.6 tttp -129.06 140.33 51.65 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.218 -178.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.4 t -137.81 145.32 42.18 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.535 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 mtt180 -140.34 128.99 22.95 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.14 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.2 t -123.82 146.78 48.12 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.928 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -150.08 152.33 24.26 Favored Glycine 0 N--CA 1.437 -1.278 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.16 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.9 m -138.85 148.72 44.06 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.113 0.482 . . . . 0.0 111.976 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.687 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.3 tm? -79.49 126.14 30.47 Favored 'General case' 0 N--CA 1.423 -1.811 0 C-N-CA 123.939 0.895 . . . . 0.0 109.121 178.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -87.53 -33.77 18.84 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.326 -0.55 . . . . 0.0 112.325 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -160.71 141.03 11.36 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -105.22 152.51 22.77 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.935 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.469 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 3.2 mm? -91.02 176.21 6.68 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.889 0.376 . . . . 0.0 110.752 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -73.95 -27.85 61.21 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.888 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -130.45 43.69 3.08 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.697 0.761 . . . . 0.0 109.971 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.469 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -152.11 97.93 2.37 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.142 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -80.32 110.57 15.88 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 71.4 m -110.76 152.8 26.18 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.122 0.487 . . . . 0.0 111.607 -177.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . 0.687 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 4.8 pm0 -68.46 132.71 47.47 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.677 177.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -74.25 -43.2 57.93 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 122.692 0.397 . . . . 0.0 111.333 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.3 t -155.52 146.41 22.35 Favored 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 119.216 -0.994 . . . . 0.0 112.101 175.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.0 m -133.13 138.56 51.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.545 176.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 58.3 m -129.83 127.85 41.11 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 114.726 -1.125 . . . . 0.0 108.993 177.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 19.8 pt -136.69 136.63 48.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-O 120.919 0.39 . . . . 0.0 111.163 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.6 t -126.85 135.36 50.88 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.909 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -135.53 130.98 19.16 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.415 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -52.33 126.53 20.85 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 121.27 1.313 . . . . 0.0 109.946 174.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.46 ' HB2' ' HB2' ' A' ' 84' ' ' LYS . 33.7 t -101.33 -46.18 5.1 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -172.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.337 0 C-N-CA 121.085 -0.578 . . . . 0.0 113.095 -175.917 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.189 0 N-CA-C 111.667 -0.573 . . . . 0.0 111.667 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -106.31 -8.09 17.42 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.066 0.46 . . . . 0.0 110.337 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -75.98 -54.57 6.67 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.114 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 66.07 177.04 0.22 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.165 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.4 mttt 56.99 81.41 0.26 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.481 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.421 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 0.5 OUTLIER -93.38 -131.77 0.01 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 123.075 2.517 . . . . 0.0 110.873 179.02 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.421 ' H ' ' HB2' ' A' ' 6' ' ' PRO . 35.6 tt0 69.23 108.31 0.05 Allowed 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 123.776 0.83 . . . . 0.0 111.116 -179.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -69.44 163.87 24.31 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.825 -177.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -73.54 148.12 43.33 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.883 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -133.58 147.59 30.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.268 0.556 . . . . 0.0 110.741 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -121.52 143.5 49.23 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.513 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -74.77 168.25 20.23 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.0 m 68.14 59.31 0.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.434 0.635 . . . . 0.0 109.777 -177.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.425 ' HA ' ' HA ' ' A' ' 42' ' ' ALA . 40.7 t0 -75.24 167.61 21.58 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.762 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.9 t -101.78 -55.21 2.56 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -176.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -157.44 159.88 30.13 Favored Glycine 0 N--CA 1.44 -1.039 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -92.91 166.27 12.48 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 117.085 0.443 . . . . 0.0 112.141 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.6 m95 -50.32 122.14 6.55 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.654 176.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -111.82 124.29 52.05 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.408 ' CE3' ' HA3' ' A' ' 37' ' ' GLY . 98.2 m95 -104.46 136.8 43.34 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.39 0.614 . . . . 0.0 112.169 -175.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.0 m -95.42 172.07 8.31 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.192 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.0 m -90.39 130.97 38.77 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 CA-C-O 121.756 0.788 . . . . 0.0 111.034 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 43.4 t -61.18 134.46 57.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.35 -1.295 . . . . 0.0 112.168 -176.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.9 t -96.8 107.93 39.99 Favored Pre-proline 0 N--CA 1.438 -1.045 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.561 ' O ' ' HB ' ' A' ' 26' ' ' THR . 18.1 Cg_endo -59.55 -19.03 50.3 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.935 2.423 . . . . 0.0 112.713 -176.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.561 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 30.7 m 85.98 -66.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.029 177.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.2 t 68.23 121.69 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.463 0.649 . . . . 0.0 111.081 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 161.05 66.53 0.02 OUTLIER Glycine 0 CA--C 1.494 -1.257 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.407 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 62.07 40.3 12.18 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 39.1 m 76.91 88.91 0.08 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.126 -178.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.63 149.43 16.87 Favored Glycine 0 CA--C 1.503 -0.665 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.4 tp -78.94 116.43 19.25 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.054 0.454 . . . . 0.0 112.089 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.31 162.32 34.9 Favored Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.085 178.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 p -136.13 154.53 50.95 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.465 0.65 . . . . 0.0 112.402 -177.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -125.21 138.44 54.12 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -118.77 129.08 55.05 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.905 0.383 . . . . 0.0 110.999 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.408 ' HA3' ' CE3' ' A' ' 20' ' ' TRP . . . -124.55 143.5 14.72 Favored Glycine 0 N--CA 1.437 -1.238 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 177.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.454 HG23 ' HB3' ' A' ' 48' ' ' MET . 50.7 p -133.3 158.41 43.02 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 117.637 0.719 . . . . 0.0 110.727 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.505 ' HG2' ' N ' ' A' ' 40' ' ' THR . 71.7 ttt180 -154.73 161.1 41.66 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.633 ' HA ' ' O ' ' A' ' 45' ' ' LYS . 1.3 p -106.58 145.79 31.47 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 174.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.89 -176.99 31.57 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.099 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.425 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . . . -70.39 -25.77 63.4 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.567 0.699 . . . . 0.0 110.441 -177.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -98.16 16.36 21.53 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.91 178.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 73.4 m 61.23 79.74 0.24 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.323 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.633 ' O ' ' HA ' ' A' ' 40' ' ' THR . 75.8 mmtt -130.36 146.03 51.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 177.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -74.75 108.46 7.51 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.03 0.443 . . . . 0.0 110.873 -177.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -115.8 136.59 52.91 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.454 ' HB3' HG23 ' A' ' 38' ' ' THR . 16.3 ptm -144.96 154.34 42.47 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -147.71 142.59 26.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.642 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.1 m -116.86 138.81 51.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 120.848 0.356 . . . . 0.0 110.476 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -120.48 152.66 37.71 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -104.78 127.35 52.55 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 57.6 m -90.69 -165.39 1.34 Allowed 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -175.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -117.55 140.06 50.12 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 120.772 0.32 . . . . 0.0 110.921 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 6.9 tp -109.77 120.22 45.53 Favored Pre-proline 0 C--N 1.305 -1.353 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.709 -178.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -62.51 103.44 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.368 2.045 . . . . 0.0 111.37 177.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.9 t -103.07 155.66 18.23 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.572 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.7 p-10 -72.25 145.48 47.9 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 121.164 -0.214 . . . . 0.0 110.6 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 88.9 m95 66.78 89.51 0.1 Allowed 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.687 0.756 . . . . 0.0 110.643 -177.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -101.11 -169.97 1.77 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.577 -178.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.492 ' HZ2' ' HB3' ' A' ' 61' ' ' LYS . 0.1 OUTLIER -78.42 52.17 1.12 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.366 0.603 . . . . 0.0 111.492 179.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -135.37 87.41 2.32 Favored 'General case' 0 N--CA 1.441 -0.89 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -84.72 15.74 3.69 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.819 -176.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -177.61 164.23 33.19 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.505 -0.855 . . . . 0.0 112.797 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -156.2 -79.87 0.08 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -89.6 -20.72 23.39 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 45.0 t -76.24 178.74 6.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.425 176.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -132.76 125.82 31.02 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.53 -178.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.433 ' HE1' ' O ' ' A' ' 100' ' ' GLN . 1.6 t80 -141.23 141.36 34.02 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.766 -177.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -123.7 134.02 53.79 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 110.498 -0.186 . . . . 0.0 110.498 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -97.09 131.64 43.67 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 176.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.432 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 3.6 pt20 -115.66 161.75 18.23 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -135.97 106.04 6.31 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 121.141 0.496 . . . . 0.0 111.288 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 59.3 t90 -79.06 -21.7 46.41 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.211 176.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -159.59 158.46 29.64 Favored Glycine 0 N--CA 1.434 -1.492 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.191 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -94.33 146.63 23.91 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 2.1 t -21.33 126.58 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.225 0 O-C-N 124.563 1.164 . . . . 0.0 112.58 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -98.29 109.16 21.96 Favored 'General case' 0 CA--C 1.494 -1.207 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 mt -75.51 -21.21 58.19 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -177.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -67.17 -36.48 81.89 Favored 'General case' 0 CA--C 1.486 -1.496 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -174.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.414 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 74.1 p -104.87 -7.28 19.48 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.875 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.432 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 61.95 37.31 15.15 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.348 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.433 ' HA ' ' H ' ' A' ' 109' ' ' CYS . 66.3 mt -128.1 152.31 48.14 Favored 'General case' 0 CA--C 1.498 -1.057 0 CA-C-O 121.276 0.56 . . . . 0.0 111.873 -176.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.401 ' HB2' ' HB2' ' A' ' 109' ' ' CYS . 87.0 tttt -135.65 136.48 41.0 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.725 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.1 t -134.52 144.49 48.05 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 120.904 0.383 . . . . 0.0 111.551 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -142.54 142.87 32.28 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.925 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.432 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 5.0 m -112.61 147.21 37.16 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.651 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -133.82 156.49 22.34 Favored Glycine 0 C--N 1.318 -0.467 0 C-N-CA 121.14 -0.552 . . . . 0.0 111.937 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.7 p -146.31 141.7 27.55 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-N 116.955 0.378 . . . . 0.0 111.941 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 5.3 tt -68.78 127.47 33.18 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.331 176.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -97.57 -31.47 12.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.613 178.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -156.77 140.07 15.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.617 0.246 . . . . 0.0 110.876 178.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -113.94 131.51 56.29 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.471 ' HB2' ' HB2' ' A' ' 97' ' ' ALA . 8.7 mp -93.19 175.94 6.59 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -178.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -76.7 -27.94 55.68 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.692 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -126.49 14.09 7.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.028 0.918 . . . . 0.0 110.698 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.471 ' HB2' ' HB2' ' A' ' 94' ' ' LEU . . . -143.23 91.2 2.25 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.111 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -103.61 152.63 21.53 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.721 -176.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 67.8 m -134.91 156.19 49.4 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 121.295 0.569 . . . . 0.0 111.855 -177.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.598 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 19.5 pm0 -64.02 149.91 46.43 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.801 -1.091 . . . . 0.0 108.449 169.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.51 ' HA ' ' HB3' ' A' ' 90' ' ' LEU . 57.3 pttt -81.52 -31.69 32.68 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -173.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.0 t -155.69 148.82 24.55 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 119.387 -0.925 . . . . 0.0 112.451 177.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 26.8 m -134.27 143.02 39.3 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.15 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.275 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 12.2 t -128.18 128.95 45.72 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-N 114.482 -1.236 . . . . 0.0 107.912 175.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.9 tt -141.07 139.69 33.23 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 CA-C-O 121.221 0.534 . . . . 0.0 111.375 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 16.3 m -130.41 127.48 39.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -133.52 132.53 21.91 Favored Pre-proline 0 C--N 1.305 -1.365 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -51.21 118.07 3.98 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 121.561 1.507 . . . . 0.0 110.956 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.433 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 9.4 t -77.52 -30.06 52.71 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.239 -176.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -88.06 -168.46 44.36 Favored Glycine 0 N--CA 1.437 -1.279 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -155.79 164.23 38.81 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-O 120.729 0.299 . . . . 0.0 110.275 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 79.0 mt -84.29 158.06 21.33 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 20.3 p -68.25 114.29 6.6 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.435 0.635 . . . . 0.0 111.812 -178.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -120.54 96.56 48.93 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.663 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.71 141.72 95.66 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.757 2.304 . . . . 0.0 112.782 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -87.14 -42.25 0.53 Allowed Pre-proline 0 C--N 1.306 -1.286 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.19 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo -88.27 104.17 0.48 Allowed 'Trans proline' 0 C--N 1.37 1.664 0 C-N-CA 121.948 1.765 . . . . 0.0 111.396 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -78.52 140.88 38.51 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.073 -179.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -71.55 175.76 5.31 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.74 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -56.26 -37.17 69.43 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.317 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.4 m 61.25 -166.86 0.2 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.754 177.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -84.94 111.84 20.04 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 58.6 pttt -72.88 -4.66 33.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.04 0.448 . . . . 0.0 111.437 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -102.42 25.39 9.06 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.536 178.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -60.53 -35.61 76.42 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.15 0.5 . . . . 0.0 110.515 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -124.58 140.09 53.27 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.715 177.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -75.52 122.28 23.64 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.13 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -130.94 159.35 22.98 Favored Glycine 0 N--CA 1.437 -1.281 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.709 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -98.28 99.79 11.03 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 120.791 0.329 . . . . 0.0 110.268 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 49.5 tptt -76.64 113.23 14.05 Favored 'General case' 0 N--CA 1.426 -1.652 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -66.69 140.16 57.88 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.163 -176.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 44.96 36.85 2.09 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.688 1.195 . . . . 0.0 113.303 177.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 94.3 mttt 62.72 -88.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.688 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 75.2 mtp -146.99 21.11 1.25 Allowed 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.006 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 47.1 tp 66.84 86.68 0.13 Allowed 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.954 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 C--N 1.31 -1.133 0 CA-C-N 114.779 -1.101 . . . . 0.0 109.394 179.102 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.377 0 N-CA-C 111.689 -0.564 . . . . 0.0 111.689 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -104.96 -15.82 15.02 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.877 0.37 . . . . 0.0 111.41 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -113.48 92.07 3.87 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.964 0.411 . . . . 0.0 112.059 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -111.91 -56.22 2.41 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -149.32 71.84 10.01 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.79 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.428 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 2.1 Cg_endo -86.81 -137.48 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.796 2.331 . . . . 0.0 111.247 -177.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.428 ' H ' ' HB2' ' A' ' 6' ' ' PRO . 36.0 tt0 61.76 78.63 0.28 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.838 -177.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -164.24 -74.44 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.023 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.6 tttt 67.52 135.83 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.452 0.701 . . . . 0.0 112.232 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.6 p -103.5 144.18 14.42 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.098 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.906 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 pttt -147.38 96.37 2.69 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.061 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -131.65 67.98 1.5 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.398 0.618 . . . . 0.0 111.38 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.8 m -126.51 25.26 6.54 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 122.121 0.962 . . . . 0.0 108.498 177.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -75.74 146.33 40.15 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 113.754 -1.566 . . . . 0.0 112.351 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.792 ' SG ' ' HA3' ' A' ' 41' ' ' GLY . 5.2 t 92.7 -77.32 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 124.846 1.258 . . . . 0.0 110.269 171.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.4 ' HA3' ' O ' ' A' ' 40' ' ' THR . . . -178.3 174.18 46.5 Favored Glycine 0 N--CA 1.435 -1.38 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 177.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -109.46 166.17 11.09 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.518 0.675 . . . . 0.0 111.243 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 98.6 m95 -65.08 128.98 38.05 Favored 'General case' 0 N--CA 1.418 -2.067 0 CA-C-N 114.462 -1.245 . . . . 0.0 111.413 174.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -87.66 137.96 31.88 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 176.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -110.27 124.02 50.87 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 121.324 0.583 . . . . 0.0 112.329 -174.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.0 m -107.13 168.51 9.16 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.21 -0.905 . . . . 0.0 108.961 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.6 m -96.51 152.9 3.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.569 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 79.3 m -66.91 129.85 41.24 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.788 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 17.1 m -109.29 111.1 60.14 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.799 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.06 156.83 63.96 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.404 2.07 . . . . 0.0 111.686 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.6 m -91.25 -25.81 19.31 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-O 121.247 0.546 . . . . 0.0 109.549 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -160.56 136.75 8.54 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.644 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -69.94 -26.96 73.69 Favored Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -80.99 54.24 2.16 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.4 m 59.41 88.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.114 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.432 ' H ' HD13 ' A' ' 55' ' ' ILE . . . -144.34 141.82 10.48 Favored Glycine 0 N--CA 1.437 -1.252 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.531 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.7 tp -57.04 152.15 13.73 Favored 'General case' 0 C--O 1.203 -1.392 0 C-N-CA 122.502 0.321 . . . . 0.0 111.38 -177.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.0 171.77 22.31 Favored Glycine 0 N--CA 1.438 -1.23 0 N-CA-C 110.57 -1.012 . . . . 0.0 110.57 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.4 p -135.68 154.18 51.37 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 117.441 0.62 . . . . 0.0 112.06 -178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -137.09 142.2 42.35 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 175.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -130.25 130.87 45.14 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 120.757 0.313 . . . . 0.0 111.627 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.54 145.81 17.52 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 71.2 p -134.91 154.76 51.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 117.843 0.821 . . . . 0.0 111.115 -177.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -118.11 154.51 31.99 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.4 ' O ' ' HA3' ' A' ' 16' ' ' GLY . 2.2 m -150.73 161.87 41.8 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.387 -175.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.792 ' HA3' ' SG ' ' A' ' 15' ' ' CYS . . . 166.16 -173.44 41.68 Favored Glycine 0 N--CA 1.434 -1.47 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.54 -32.72 64.36 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 117.593 0.696 . . . . 0.0 111.411 -178.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -105.52 0.97 27.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.961 0.41 . . . . 0.0 111.843 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 78.2 m -98.71 117.32 32.91 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 120.91 0.386 . . . . 0.0 111.858 -177.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.77 140.56 40.68 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.793 175.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 62.53 19.79 11.49 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.671 0.607 . . . . 0.0 111.466 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -84.11 77.89 9.86 Favored 'General case' 0 N--CA 1.437 -1.105 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 177.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 55.2 mtt -134.31 152.86 52.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.057 -175.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -148.54 131.45 16.15 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.374 178.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.2 m -117.1 138.02 51.91 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -131.62 152.24 50.98 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 120.729 0.299 . . . . 0.0 110.824 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -85.95 129.44 34.83 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 176.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 9.1 t -95.78 178.83 5.32 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -175.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -113.65 141.14 47.58 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.438 0.637 . . . . 0.0 111.284 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.432 HD13 ' H ' ' A' ' 31' ' ' GLY . 12.4 tt -123.59 120.29 26.93 Favored Pre-proline 0 C--N 1.299 -1.605 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.64 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -70.41 98.44 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.375 2.05 . . . . 0.0 111.822 178.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 54.1 t -80.85 114.03 19.46 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.924 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -84.67 129.21 34.86 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.942 0.401 . . . . 0.0 111.623 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 48.3 m95 53.61 68.07 0.9 Allowed 'General case' 0 C--O 1.239 0.522 0 CA-C-N 114.981 -1.009 . . . . 0.0 112.339 177.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -91.95 -11.83 35.06 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.628 0.727 . . . . 0.0 109.385 177.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -65.88 114.11 4.86 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.707 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.417 ' C ' ' H ' ' A' ' 64' ' ' GLY . 78.0 mt-30 -142.65 24.66 1.87 Allowed 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.13 -177.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 79.3 t80 75.95 -37.3 0.31 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.622 0.769 . . . . 0.0 112.335 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.417 ' H ' ' C ' ' A' ' 62' ' ' GLN . . . -158.24 132.12 3.03 Favored Glycine 0 C--N 1.29 -2.008 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.626 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.06 -75.99 0.59 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.622 0.248 . . . . 0.0 110.701 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -93.68 -21.58 19.27 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.161 0.505 . . . . 0.0 110.588 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 56.3 m -83.42 160.52 21.56 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.378 178.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -130.81 127.82 39.43 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.831 ' CE2' ' HB2' ' A' ' 90' ' ' LEU . 54.8 m-85 -109.27 128.47 55.1 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.611 -178.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -100.51 117.58 34.94 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 177.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.522 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 44.2 p90 -99.02 145.11 27.41 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-O 120.83 0.347 . . . . 0.0 111.158 -176.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -89.78 162.34 15.57 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 71.74 116.85 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.16 0.912 . . . . 0.0 110.661 -175.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -89.11 -3.12 58.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.757 0.789 . . . . 0.0 109.826 -177.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.92 140.13 11.54 Favored Glycine 0 N--CA 1.436 -1.336 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.943 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -107.98 141.23 39.95 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.565 ' HA ' ' HB3' ' A' ' 84' ' ' LYS . 48.9 t 79.53 102.24 0.07 Allowed 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 121.662 0.744 . . . . 0.0 110.777 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -83.73 111.85 19.54 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 114.874 -1.057 . . . . 0.0 108.51 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -63.82 -31.81 73.12 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.612 -1.176 . . . . 0.0 113.254 -173.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -74.95 -28.7 60.69 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.438 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.625 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.7 p -105.19 -8.55 18.29 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 120.004 -0.678 . . . . 0.0 112.44 -175.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.32 25.08 12.33 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 123.466 0.706 . . . . 0.0 110.625 -175.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.625 ' HG ' ' O ' ' A' ' 81' ' ' THR . 44.9 mt -128.71 149.49 50.67 Favored 'General case' 0 C--O 1.202 -1.437 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.121 -177.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.565 ' HB3' ' HA ' ' A' ' 77' ' ' CYS . 8.3 ptmt -121.58 135.46 55.0 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 120.879 0.371 . . . . 0.0 110.246 177.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.3 m -137.95 138.3 38.82 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -177.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -140.33 136.42 33.19 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 120.814 0.34 . . . . 0.0 110.179 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.5 m -128.75 134.23 48.36 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.63 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.522 ' HA2' ' HA ' ' A' ' 71' ' ' PHE . . . -135.69 152.3 20.92 Favored Glycine 0 CA--C 1.495 -1.214 0 C-N-CA 120.466 -0.874 . . . . 0.0 111.784 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 20.1 p -141.04 146.42 37.18 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.24 0.543 . . . . 0.0 111.961 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.831 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.8 tm? -91.29 121.46 33.05 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -97.4 -12.39 22.81 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -174.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 14.9 ttm180 -161.57 133.76 5.8 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.564 0.221 . . . . 0.0 110.496 178.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -113.6 148.6 35.91 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.8 mp -85.74 172.09 11.09 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 -178.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -78.46 -18.38 54.95 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.112 0.482 . . . . 0.0 110.404 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -119.63 37.6 4.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.698 0.761 . . . . 0.0 109.706 179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -157.63 124.26 4.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.335 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -111.1 122.98 49.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.648 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . 0.453 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 74.7 m -145.68 148.3 32.9 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.956 -0.566 . . . . 0.0 112.177 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.74 152.54 45.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.267 178.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -73.52 -35.72 65.62 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.915 -175.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.402 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 9.3 t -156.26 148.91 23.8 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 118.877 -1.129 . . . . 0.0 113.449 179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.1 m -131.63 139.26 51.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 113.8 -1.546 . . . . 0.0 110.83 175.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 56.7 m -129.74 133.78 47.22 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.411 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.48 132.08 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 4.8 m -131.82 126.28 33.94 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -135.5 138.17 27.89 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -62.71 123.15 11.81 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 121.7 1.6 . . . . 0.0 110.252 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.16 178.37 8.14 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.763 0.316 . . . . 0.0 110.479 -176.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 92.03 -45.81 2.66 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -177.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -85.74 112.76 21.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.652 -0.274 . . . . 0.0 110.493 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 57.94 86.99 0.07 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.374 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 19.6 p -91.92 122.49 34.49 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.097 178.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -152.8 89.2 3.79 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-O 120.719 0.295 . . . . 0.0 110.956 -178.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -67.06 146.02 75.48 Favored 'Trans proline' 0 CA--C 1.514 -0.504 0 C-N-CA 122.699 2.266 . . . . 0.0 111.912 177.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.468 ' N ' ' HD3' ' A' ' 117' ' ' PRO . 40.4 ttmt -149.5 60.55 4.62 Favored Pre-proline 0 C--N 1.309 -1.178 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.452 174.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.468 ' HD3' ' N ' ' A' ' 116' ' ' LYS . 35.7 Cg_exo -61.7 89.73 0.1 Allowed 'Trans proline' 0 C--N 1.365 1.415 0 C-N-CA 122.366 2.044 . . . . 0.0 111.58 175.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -94.32 -29.7 14.9 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.06 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -69.93 100.84 1.64 Allowed 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.343 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.404 ' HG3' ' NZ ' ' A' ' 123' ' ' LYS . 6.9 pt-20 -97.24 130.8 44.41 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.769 -178.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 21.9 p -127.68 -165.42 1.48 Allowed 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.456 178.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 75.8 -1.72 2.92 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.404 ' NZ ' ' HG3' ' A' ' 120' ' ' GLU . 14.5 pttm -83.71 -0.58 51.41 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.072 0.463 . . . . 0.0 111.096 178.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -112.54 135.77 52.86 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -73.71 -24.47 59.93 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.116 0.484 . . . . 0.0 110.016 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -102.73 135.27 44.69 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.646 -0.707 . . . . 0.0 109.917 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -143.26 144.08 31.99 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.894 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 148.54 88.0 0.07 OUTLIER Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 -177.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -95.48 26.18 4.04 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -81.27 106.13 13.01 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.744 -176.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -129.65 95.94 4.12 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 176.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -107.41 -179.67 3.99 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.631 -176.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -69.12 133.95 48.69 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.402 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 93.7 mmm -93.42 102.55 14.79 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 177.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 8.5 mp 70.36 135.31 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.655 0.782 . . . . 0.0 111.688 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 . . . . . 0 C--N 1.312 -1.04 0 CA-C-O 118.662 -0.685 . . . . 0.0 110.199 -179.184 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.526 0 N-CA-C 111.822 -0.511 . . . . 0.0 111.822 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -77.85 110.97 13.21 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -64.12 108.12 1.46 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.722 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.43 35.96 1.09 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.348 -179.111 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.6 mttt 63.36 77.23 0.33 Allowed Pre-proline 0 N--CA 1.469 0.477 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.841 -178.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.43 ' CG ' ' H ' ' A' ' 7' ' ' GLU . 66.9 Cg_endo -92.06 -85.44 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.601 0 C-N-CA 122.739 2.293 . . . . 0.0 113.01 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.43 ' H ' ' CG ' ' A' ' 6' ' ' PRO . 45.3 mt-10 -88.67 155.6 19.5 Favored 'General case' 0 C--N 1.287 -2.135 0 CA-C-N 114.832 -1.076 . . . . 0.0 112.036 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.1 tptp 74.44 -48.56 0.65 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.544 1.138 . . . . 0.0 112.056 178.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -110.71 104.07 12.69 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-O 121.223 0.535 . . . . 0.0 110.174 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.7 p -89.15 152.96 3.26 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.395 -177.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -80.99 137.29 36.08 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.086 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.3 tttm 57.4 94.18 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.579 0.752 . . . . 0.0 112.151 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.7 p -77.64 -10.51 59.55 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.854 0.835 . . . . 0.0 110.184 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.407 ' O ' ' HB2' ' A' ' 15' ' ' CYS . 29.8 t70 -87.82 149.07 24.37 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 114.035 -1.439 . . . . 0.0 109.772 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 14' ' ' ASP . 74.4 m 70.5 81.32 0.16 Allowed 'General case' 0 C--O 1.233 0.217 0 O-C-N 123.695 0.622 . . . . 0.0 110.487 -177.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.13 174.69 40.25 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.193 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -75.83 171.3 14.62 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 122.46 0.304 . . . . 0.0 110.858 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.637 ' HA ' ' O ' ' A' ' 38' ' ' THR . 88.5 m95 -45.92 119.51 2.27 Favored 'General case' 0 N--CA 1.442 -0.839 0 O-C-N 123.894 0.746 . . . . 0.0 112.698 -177.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.452 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 68.3 mt-30 -113.15 115.56 28.46 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -100.45 138.69 37.17 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.225 0.536 . . . . 0.0 111.481 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.0 t -101.33 172.44 6.99 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.416 -0.811 . . . . 0.0 108.895 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 29.1 m -91.95 148.56 4.56 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 62.3 m -63.6 128.41 35.7 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.829 -175.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 p -106.23 114.79 61.99 Favored Pre-proline 0 N--CA 1.44 -0.93 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -61.29 148.09 93.83 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.599 2.2 . . . . 0.0 112.972 -176.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.3 m -87.64 -28.53 21.81 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-O 121.678 0.752 . . . . 0.0 109.195 178.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 46.3 t -149.95 134.58 17.56 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.888 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.07 -30.57 69.78 Favored Glycine 0 CA--C 1.504 -0.616 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.338 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.556 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 6.5 m-20 -68.17 -41.47 81.44 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.3 m 166.02 92.15 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.583 1.153 . . . . 0.0 110.847 178.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -141.31 120.09 1.62 Allowed Glycine 0 CA--C 1.498 -0.976 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.895 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -53.68 114.13 1.43 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.998 0.428 . . . . 0.0 111.671 -176.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.96 175.77 53.96 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.886 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 p -136.42 154.66 50.73 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -133.71 146.04 50.44 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.001 176.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -120.82 131.56 54.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.514 0.197 . . . . 0.0 110.649 -178.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.452 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -128.21 151.37 18.76 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 178.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.637 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 58.8 p -130.0 149.37 51.75 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 117.395 0.598 . . . . 0.0 111.25 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.495 ' HB2' ' CE2' ' A' ' 18' ' ' TRP . 53.2 ttp180 -132.24 161.4 33.53 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.49 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 9.0 t -113.75 162.7 15.97 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-O 121.756 0.788 . . . . 0.0 111.087 178.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -111.82 -174.29 19.67 Favored Glycine 0 C--N 1.294 -1.788 0 CA-C-N 114.042 -1.435 . . . . 0.0 110.058 177.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.94 -30.51 69.83 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 117.562 0.681 . . . . 0.0 110.099 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -101.93 5.44 40.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.412 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.404 ' HA ' ' OG1' ' A' ' 40' ' ' THR . 52.9 t 60.51 70.85 0.6 Allowed 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.991 -175.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -90.89 -18.41 24.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.055 -178.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.423 ' HA ' ' O ' ' A' ' 39' ' ' ARG . 15.3 mm100 66.74 100.56 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.893 0.854 . . . . 0.0 112.829 178.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 m -101.72 143.32 31.8 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 114.74 -1.118 . . . . 0.0 108.542 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -120.85 152.59 38.21 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.18 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -141.89 136.07 30.12 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.9 m -129.77 136.72 49.96 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -133.64 151.1 51.6 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-O 121.053 0.454 . . . . 0.0 111.294 -176.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.481 ' HD2' ' N ' ' A' ' 52' ' ' ARG . 0.2 OUTLIER -101.91 128.1 48.45 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.44 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 31.7 m -92.65 170.58 9.61 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 -174.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.7 mttm -113.79 139.91 48.74 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.371 0.605 . . . . 0.0 112.125 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.9 mt -112.37 131.54 22.55 Favored Pre-proline 0 C--N 1.305 -1.369 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.631 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.447 ' O ' ' HB2' ' A' ' 57' ' ' CYS . 9.5 Cg_endo -52.45 -54.5 5.08 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.426 2.75 . . . . 0.0 113.486 -178.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 56' ' ' PRO . 41.9 m 73.43 -51.18 0.7 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.085 0.554 . . . . 0.0 112.357 -178.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -75.95 132.43 40.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.176 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 91.1 m95 54.72 42.87 30.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.401 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.556 ' HE3' ' O ' ' A' ' 29' ' ' ASP . 22.3 pttm -86.04 6.0 30.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.018 0.437 . . . . 0.0 111.234 178.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -81.6 131.31 35.27 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.031 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -164.24 123.19 1.9 Allowed 'General case' 0 N--CA 1.439 -1.018 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -178.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -72.54 129.97 39.54 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.316 -178.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -136.56 172.71 22.39 Favored Glycine 0 N--CA 1.442 -0.949 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -132.66 1.19 3.66 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -82.92 -20.93 34.41 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.245 0.545 . . . . 0.0 110.455 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.5 p -99.67 -176.48 3.28 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 175.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -129.85 142.44 50.67 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.491 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.482 ' HH ' ' NE2' ' A' ' 100' ' ' GLN . 29.6 m-85 -117.44 152.49 34.89 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.01 -178.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -124.96 118.77 26.98 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -95.79 135.57 37.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.201 0.524 . . . . 0.0 111.135 -178.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.446 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 0.2 OUTLIER -110.5 162.17 14.96 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.808 -178.577 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -124.55 87.27 2.69 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.152 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 47.9 t-105 -87.24 -24.35 24.42 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.417 0.627 . . . . 0.0 109.526 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -161.62 118.19 0.81 Allowed Glycine 0 N--CA 1.439 -1.154 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.764 178.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -96.85 116.23 28.8 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.516 ' SG ' ' HG3' ' A' ' 84' ' ' LYS . 55.7 m 59.99 102.06 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.917 0.76 . . . . 0.0 112.022 -176.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -69.81 111.94 5.9 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 177.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 20.2 mt -69.29 -28.93 66.71 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.695 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -65.27 -38.59 90.77 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.219 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 65.7 p -106.72 -14.59 14.97 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.278 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 69.48 39.89 1.53 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.921 -1.036 . . . . 0.0 108.727 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.463 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 90.3 mt -125.34 168.01 14.13 Favored 'General case' 0 C--O 1.204 -1.321 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.859 -178.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.516 ' HG3' ' SG ' ' A' ' 77' ' ' CYS . 36.1 tttm -121.15 137.44 54.67 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -177.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 14.2 t -137.12 146.7 45.37 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.495 0.664 . . . . 0.0 110.878 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -137.56 135.54 36.77 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.39 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.446 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 33.4 m -107.44 141.97 38.0 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -136.47 152.57 21.25 Favored Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.459 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 19.0 m -141.08 147.94 39.37 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.063 0.459 . . . . 0.0 111.28 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.1 tm? -72.73 119.03 16.4 Favored 'General case' 0 N--CA 1.408 -2.571 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.388 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -105.39 -25.69 12.27 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 120.429 -0.509 . . . . 0.0 111.114 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -155.85 133.61 11.15 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.042 0.448 . . . . 0.0 111.004 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -135.47 150.72 49.89 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.788 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.4 mp -84.49 158.99 20.82 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 177.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -68.29 -27.08 66.0 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.757 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -100.37 38.85 1.43 Allowed 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.509 0.671 . . . . 0.0 109.304 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.83 99.26 1.39 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.626 -177.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -84.23 133.19 34.59 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.974 179.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 74.8 m -145.94 140.71 27.13 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.811 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.573 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -67.54 153.87 42.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.707 178.647 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.518 ' HD3' ' H ' ' A' ' 101' ' ' LYS . 0.3 OUTLIER -73.93 -26.52 60.56 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.316 -174.671 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 8.8 t -149.22 149.82 31.59 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-O 122.016 0.912 . . . . 0.0 113.043 179.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 29.6 m -129.17 144.04 39.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 113.857 -1.52 . . . . 0.0 110.749 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 34.6 m -129.51 131.8 46.72 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.839 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.09 136.39 47.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.807 0.337 . . . . 0.0 110.358 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.3 p -123.18 137.0 55.0 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.549 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -134.46 128.78 19.32 Favored Pre-proline 0 C--O 1.21 -1.019 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.553 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -50.29 126.21 16.95 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 122.129 1.886 . . . . 0.0 112.394 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.425 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 43.1 t -97.71 107.13 19.56 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.569 -177.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -142.23 -77.81 0.04 OUTLIER Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.072 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -125.63 168.38 13.8 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.823 -0.222 . . . . 0.0 110.881 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.3 tp 60.6 74.84 0.43 Allowed 'General case' 0 C--O 1.238 0.454 0 O-C-N 123.975 0.797 . . . . 0.0 110.572 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 6.8 p -104.49 142.79 33.98 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.206 -178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.404 ' HD3' ' C ' ' A' ' 114' ' ' LYS . 9.5 tmtt? -125.62 92.42 46.62 Favored Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -76.76 -161.54 0.14 Allowed 'Trans proline' 0 CA--C 1.531 0.373 0 C-N-CA 123.108 2.539 . . . . 0.0 113.089 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.562 ' H ' ' CD ' ' A' ' 117' ' ' PRO . 64.3 tttp -160.03 -40.52 0.0 OUTLIER Pre-proline 0 CA--C 1.55 0.978 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.653 -179.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.562 ' CD ' ' H ' ' A' ' 116' ' ' LYS . 14.7 Cg_exo -70.9 128.69 15.31 Favored 'Trans proline' 0 C--N 1.378 2.092 0 C-N-CA 121.62 1.547 . . . . 0.0 111.017 179.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -77.99 -22.06 49.95 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.412 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -101.71 154.05 19.24 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.338 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.463 ' OE1' ' HE2' ' A' ' 122' ' ' LYS . 29.3 mm-40 -70.12 105.45 2.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.317 0.579 . . . . 0.0 110.479 178.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 20.2 m -99.23 34.05 2.26 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.052 -177.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.463 ' HE2' ' OE1' ' A' ' 120' ' ' GLU . 67.6 mttm -72.63 96.53 2.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.111 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -72.96 109.77 6.76 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.741 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -85.2 139.2 31.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.374 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -82.79 101.17 10.76 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -125.16 167.61 14.58 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.409 -177.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -81.99 94.78 7.23 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.215 0.531 . . . . 0.0 110.24 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -138.77 61.84 0.57 Allowed Glycine 0 N--CA 1.44 -1.056 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.27 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -145.97 119.24 8.93 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.717 0.294 . . . . 0.0 110.77 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -70.51 133.77 47.1 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -71.98 119.31 15.98 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -70.3 97.54 1.26 Allowed 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.16 0.505 . . . . 0.0 112.116 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -93.0 142.72 26.98 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.794 177.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 91.4 mmm -69.46 158.14 35.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.993 0.425 . . . . 0.0 111.667 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 81.9 mt -81.56 170.89 15.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.36 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.226 178.913 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.063 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -75.95 93.81 3.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.62 0.248 . . . . 0.0 110.454 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.2 pttp -171.13 170.01 6.28 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.249 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -94.56 178.85 5.47 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.725 176.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm 54.5 88.53 0.12 Allowed Pre-proline 0 CA--C 1.533 0.324 0 C-N-CA 123.283 0.633 . . . . 0.0 112.458 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.91 -91.14 0.0 OUTLIER 'Trans proline' 0 CA--C 1.514 -0.504 0 C-N-CA 122.502 2.135 . . . . 0.0 111.781 177.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 67.17 163.04 0.19 Allowed 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.991 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.403 ' HG2' ' H ' ' A' ' 9' ' ' LYS . 24.0 tttp -138.96 -167.22 2.17 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.403 ' H ' ' HG2' ' A' ' 8' ' ' LYS . 33.5 mtmm 68.53 -177.45 0.21 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.174 0.511 . . . . 0.0 111.208 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.2 p -140.47 150.34 21.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.359 177.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -94.22 179.61 5.25 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.014 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -76.54 -29.67 56.8 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 175.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.1 p -99.07 97.82 8.91 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.443 174.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.462 ' O ' ' HB3' ' A' ' 15' ' ' CYS . 7.8 p-10 -114.57 165.33 12.89 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.916 -175.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.462 ' HB3' ' O ' ' A' ' 14' ' ' ASP . 49.4 t 95.15 -40.35 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.03 1.332 . . . . 0.0 111.816 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.473 ' O ' ' HD2' ' A' ' 39' ' ' ARG . . . 179.06 128.88 1.23 Allowed Glycine 0 N--CA 1.438 -1.2 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -102.91 164.62 11.51 Favored 'General case' 0 CA--C 1.494 -1.198 0 CA-C-N 117.341 0.57 . . . . 0.0 110.552 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.544 ' CD2' ' HB2' ' A' ' 39' ' ' ARG . 74.6 m95 -52.57 118.14 3.4 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.2 mm-40 -119.33 112.74 19.81 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 172.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -97.35 145.08 26.48 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.042 -177.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.8 m -93.77 171.68 8.72 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.955 -1.02 . . . . 0.0 108.583 177.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.493 ' HA ' ' NE2' ' A' ' 131' ' ' GLN . 35.3 m -93.53 155.71 3.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.253 -176.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 38.0 t -69.03 99.98 1.16 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 -176.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.2 p -94.48 132.96 27.75 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.652 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.0 110.94 0.75 Allowed 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.641 2.227 . . . . 0.0 111.728 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 97.0 m -65.95 -23.14 66.54 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.146 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.409 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 12.2 t -133.14 176.56 8.4 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.927 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.47 80.26 0.01 OUTLIER Glycine 0 C--N 1.334 0.454 0 O-C-N 124.006 0.816 . . . . 0.0 113.658 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.9 t70 76.67 -38.99 0.33 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.506 1.122 . . . . 0.0 111.939 175.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 47.4 t -123.66 109.61 13.94 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.934 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.409 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -172.94 154.99 22.0 Favored Glycine 0 CA--C 1.491 -1.42 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 -178.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.5 tp -64.13 108.99 1.69 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 118.224 1.012 . . . . 0.0 109.01 178.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.26 175.31 25.12 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.113 -0.948 . . . . 0.0 114.825 -173.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.84 153.66 50.72 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.694 -0.753 . . . . 0.0 111.395 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -144.15 138.35 28.09 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -115.57 132.01 56.76 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.797 -0.183 . . . . 0.0 111.333 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -131.24 136.22 8.69 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 177.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.543 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 6.9 p -123.89 148.24 46.99 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 121.194 -0.202 . . . . 0.0 111.076 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.544 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 11.2 tpt85 -157.01 160.1 38.67 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.402 ' OG1' ' HA3' ' A' ' 16' ' ' GLY . 0.2 OUTLIER -150.58 146.17 26.38 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.513 175.484 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -98.72 -150.35 25.78 Favored Glycine 0 C--O 1.217 -0.967 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.84 -36.56 49.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 118.085 0.942 . . . . 0.0 109.681 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 20.6 mm-40 -85.47 -0.52 55.15 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.216 174.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 5.2 m 40.05 60.57 1.7 Allowed 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.749 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 36.2 mmtm -118.28 141.8 48.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.028 0.442 . . . . 0.0 112.038 -178.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.441 ' O ' ' HG3' ' A' ' 48' ' ' MET . 47.9 mt-30 45.22 -108.34 0.15 Allowed 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.082 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.434 ' O ' ' HB3' ' A' ' 39' ' ' ARG . 0.8 OUTLIER 48.32 27.74 1.43 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 178.693 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.441 ' HG3' ' O ' ' A' ' 46' ' ' GLN . 86.9 mtp -113.96 146.12 40.57 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -147.6 137.37 22.76 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.469 0.652 . . . . 0.0 111.78 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.1 p -114.4 138.46 50.54 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 174.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -134.1 151.53 51.42 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-O 121.875 0.845 . . . . 0.0 112.098 -174.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -85.67 139.05 31.7 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 113.677 -1.601 . . . . 0.0 109.144 172.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 52.9 t -117.98 159.24 23.5 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -173.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.5 tttm -114.27 124.88 53.11 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 52.9 mt -101.94 128.47 28.61 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.413 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.78 48.66 2.25 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 123.131 2.554 . . . . 0.0 113.107 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 26.8 p -104.03 177.53 4.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.712 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -77.87 147.22 35.22 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.227 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 79.5 m95 60.52 100.47 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.872 0.733 . . . . 0.0 111.504 -178.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -128.12 149.62 50.34 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.496 -177.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -129.41 170.23 13.93 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.587 176.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -159.7 39.76 0.2 Allowed 'General case' 0 N--CA 1.434 -1.258 0 CA-C-O 121.315 0.578 . . . . 0.0 109.567 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -96.16 179.79 4.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.84 -178.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -123.47 -162.91 11.62 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.833 -0.699 . . . . 0.0 111.992 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.62 -62.87 1.43 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.878 0.37 . . . . 0.0 110.731 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -86.28 -5.15 59.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.131 0.491 . . . . 0.0 110.505 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 62.8 m -65.73 141.01 58.49 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.686 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -116.8 125.39 51.53 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.454 ' HE2' ' HB2' ' A' ' 90' ' ' LEU . 36.5 m-85 -126.41 146.85 49.91 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -173.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB2' ' HE3' ' A' ' 91' ' ' LYS . 64.2 tt0 -126.49 115.73 20.01 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 106.189 -1.782 . . . . 0.0 106.189 170.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -101.29 156.42 17.46 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -173.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.423 ' O ' ' HB1' ' A' ' 73' ' ' ALA . 35.3 tt0 -78.66 144.76 35.07 Favored 'General case' 0 N--CA 1.4 -2.971 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 172.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.423 ' HB1' ' O ' ' A' ' 72' ' ' GLN . . . 166.5 120.91 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.288 0.367 . . . . 0.0 110.45 -173.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' TRP . . . . . 0.497 ' CZ3' ' HB2' ' A' ' 76' ' ' GLU . 1.1 p-90 -92.16 -8.66 44.95 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.239 0.542 . . . . 0.0 110.379 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 107.87 -39.32 2.94 Favored Glycine 0 CA--C 1.507 -0.437 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.04 175.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.497 ' HB2' ' CZ3' ' A' ' 74' ' ' TRP . 36.9 mt-10 -95.65 142.6 27.77 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 114.978 -0.611 . . . . 0.0 110.34 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 31.0 p -78.31 171.14 15.51 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 176.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -94.06 121.53 35.64 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.491 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 20.8 mt -72.83 -30.15 63.8 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.14 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -67.45 -33.36 74.98 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 121.321 0.581 . . . . 0.0 110.125 -177.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.721 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 76.8 p -104.27 -9.25 18.72 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.643 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.19 24.64 11.62 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.126 0.97 . . . . 0.0 111.475 -177.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 81' ' ' THR . 65.6 mt -131.39 165.08 24.28 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-O 120.961 0.41 . . . . 0.0 110.41 -172.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -119.83 132.71 55.66 Favored 'General case' 0 N--CA 1.414 -2.253 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.2 p -135.14 142.0 46.09 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.027 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.6 mtm180 -139.94 128.49 22.93 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.2 m -99.95 145.34 27.96 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -145.31 149.37 21.49 Favored Glycine 0 N--CA 1.434 -1.478 0 C-N-CA 118.879 -1.629 . . . . 0.0 112.664 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.447 ' HA ' ' O ' ' A' ' 101' ' ' LYS . 29.1 m -132.12 149.34 52.43 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.103 -0.549 . . . . 0.0 111.015 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.1 tm? -75.48 122.04 23.25 Favored 'General case' 0 N--CA 1.414 -2.268 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 70' ' ' GLN . 11.4 ptpt -101.26 -15.23 17.36 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -177.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -162.55 130.82 3.97 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -138.22 144.19 40.5 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.4 mp -91.28 170.54 9.9 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.442 178.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -69.54 -13.42 62.33 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.278 0.561 . . . . 0.0 110.996 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -107.15 29.92 6.67 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.16 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.55 115.95 3.79 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.445 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -87.69 123.46 32.55 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 80.4 m -134.83 139.76 45.32 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.541 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 1.2 pm0 -70.03 145.18 51.93 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.193 176.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' A' ' 89' ' ' SER . 36.4 ttpt -72.25 -42.47 65.62 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.225 -176.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.2 t -152.44 148.19 27.15 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 118.512 -1.275 . . . . 0.0 113.019 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.3 m -131.88 149.35 32.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.88 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 11.3 t -114.08 139.61 49.16 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 114.238 -1.346 . . . . 0.0 109.12 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 13.3 mt -131.03 138.31 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.118 0 CA-C-O 120.917 0.389 . . . . 0.0 111.015 -173.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.7 t -130.09 128.9 42.8 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.03 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -136.09 129.32 17.95 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.294 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.84 113.65 3.07 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 121.086 1.19 . . . . 0.0 110.61 175.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 50.7 t -81.3 67.41 7.23 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -175.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 55.1 -129.06 45.21 Favored Glycine 0 C--O 1.239 0.425 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.708 177.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 42.8 mttp 57.18 46.07 19.5 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 121.714 0.769 . . . . 0.0 110.589 179.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 48.3 tp 57.36 86.55 0.07 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 113.706 -1.588 . . . . 0.0 111.199 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 16.4 p -77.04 115.3 16.7 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.785 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -139.47 82.58 18.4 Favored Pre-proline 0 C--N 1.312 -1.031 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.62 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -71.15 -75.31 0.01 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.903 2.402 . . . . 0.0 112.741 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 23.8 pttm 30.06 63.33 0.9 Allowed Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.323 1.049 . . . . 0.0 113.372 -173.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.64 68.13 0.25 Allowed 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 123.248 2.632 . . . . 0.0 113.94 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 72.81 -37.87 0.4 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.001 0.92 . . . . 0.0 113.257 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 64.63 67.77 0.55 Allowed 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.454 0.645 . . . . 0.0 110.979 -178.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -83.92 -56.15 3.85 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.298 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 61.1 p -156.93 155.14 30.86 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.353 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -70.88 99.01 1.67 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 9.6 pttm 64.43 169.11 0.18 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.491 1.116 . . . . 0.0 111.515 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -91.57 163.42 14.14 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.398 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -86.97 3.12 47.1 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.257 0.551 . . . . 0.0 110.543 179.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -89.91 -171.49 3.17 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.057 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 69.16 9.51 7.4 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.153 0.581 . . . . 0.0 112.208 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -86.6 68.73 3.23 Favored Glycine 0 N--CA 1.438 -1.174 0 C-N-CA 120.853 -0.689 . . . . 0.0 111.891 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -73.63 109.77 7.4 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -78.81 42.11 0.44 Allowed 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.653 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.493 ' NE2' ' HA ' ' A' ' 22' ' ' VAL . 88.0 mm-40 62.53 -167.89 0.2 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.061 0.544 . . . . 0.0 111.446 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -87.8 121.81 30.68 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.884 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -68.05 107.17 2.61 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.082 -179.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 66.1 mtt -74.92 123.06 24.4 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.777 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.8 mt 68.02 160.58 0.17 Allowed 'General case' 0 C--O 1.239 0.549 0 O-C-N 123.887 0.742 . . . . 0.0 111.793 -179.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 36.5 t70 . . . . . 0 C--N 1.316 -0.882 0 CA-C-O 118.802 -0.618 . . . . 0.0 109.88 -179.531 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.075 0 N-CA-C 111.591 -0.604 . . . . 0.0 111.591 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 58.6 tttp 65.1 99.23 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.173 0.589 . . . . 0.0 111.655 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -83.54 134.37 34.83 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 177.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -61.51 -41.73 97.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.556 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.7 tttm 64.39 94.77 0.05 OUTLIER Pre-proline 0 CA--C 1.536 0.44 0 O-C-N 123.844 0.715 . . . . 0.0 111.222 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.22 -94.34 0.01 OUTLIER 'Trans proline' 0 CA--C 1.517 -0.332 0 C-N-CA 122.673 2.249 . . . . 0.0 112.569 -179.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 58.06 85.26 0.09 Allowed 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.338 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -113.97 144.13 43.58 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.435 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -62.1 120.49 10.97 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-O 121.207 0.527 . . . . 0.0 111.635 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.9 p -107.8 157.83 7.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.048 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -93.4 -166.75 1.58 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.671 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -65.65 96.51 0.27 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.176 0.512 . . . . 0.0 110.452 177.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.7 p -86.7 142.36 28.24 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.921 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' A' ' 15' ' ' CYS . 38.3 t70 -90.5 115.93 28.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.034 0.445 . . . . 0.0 111.61 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 14' ' ' ASP . 34.4 t 171.47 -69.03 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.592 -1.185 . . . . 0.0 108.987 178.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -154.98 155.14 26.02 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -86.91 166.92 14.76 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -50.63 122.04 6.65 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.988 -1.006 . . . . 0.0 112.389 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -103.51 136.73 42.7 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 176.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -120.83 130.89 54.15 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.634 0.73 . . . . 0.0 112.425 -175.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.2 t -94.49 171.82 8.57 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 114.502 -1.226 . . . . 0.0 107.845 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.8 m -92.36 142.67 12.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.042 -178.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.8 t -66.36 132.43 48.32 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.362 -176.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.4 t -93.11 116.35 66.36 Favored Pre-proline 0 C--N 1.311 -1.102 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.509 ' O ' ' HB ' ' A' ' 26' ' ' THR . 19.2 Cg_endo -57.62 -23.96 59.89 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.169 2.579 . . . . 0.0 113.138 -175.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.509 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 55.5 m 83.01 -41.92 0.1 Allowed 'General case' 0 C--O 1.234 0.238 0 C-N-CA 123.209 0.604 . . . . 0.0 111.091 177.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 t 70.41 -146.56 0.08 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.736 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 64.46 51.5 51.73 Favored Glycine 0 CA--C 1.498 -1.029 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -176.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.8 t70 72.92 -57.72 0.62 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.624 0.77 . . . . 0.0 111.146 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 68.1 m -155.21 96.95 1.87 Allowed 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 123.597 0.759 . . . . 0.0 109.043 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.407 ' H ' HD13 ' A' ' 55' ' ' ILE . . . -120.84 145.85 17.39 Favored Glycine 0 N--CA 1.431 -1.682 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.887 -179.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.7 tp -72.39 109.45 6.1 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.71 155.08 52.76 Favored Glycine 0 N--CA 1.438 -1.181 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.14 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.0 p -135.43 152.27 51.22 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.228 0.537 . . . . 0.0 111.306 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -133.49 149.31 51.73 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -130.37 131.11 45.16 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 120.723 0.297 . . . . 0.0 110.917 -178.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -123.07 144.72 15.86 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 109.771 -1.331 . . . . 0.0 109.771 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 28.2 p -134.91 153.94 51.87 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 117.429 0.615 . . . . 0.0 111.65 -177.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.43 ' HG2' ' N ' ' A' ' 40' ' ' THR . 22.6 ttt180 -149.53 161.35 42.3 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.479 ' HA ' ' O ' ' A' ' 45' ' ' LYS . 1.3 p -104.95 154.42 20.12 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 177.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -87.35 -166.53 42.61 Favored Glycine 0 CA--C 1.507 -0.423 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.79 -23.33 58.49 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 118.46 1.13 . . . . 0.0 108.911 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -94.86 7.79 44.81 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.495 -1.23 . . . . 0.0 109.587 176.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.472 ' HA ' ' HB ' ' A' ' 40' ' ' THR . 93.7 m 65.08 30.32 11.67 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.996 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.479 ' O ' ' HA ' ' A' ' 40' ' ' THR . 32.8 mmtp -80.05 -178.34 6.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.668 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -96.2 109.21 21.71 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.976 0.417 . . . . 0.0 111.904 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -109.43 126.38 53.41 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 175.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 27.3 ttt -137.02 153.25 50.69 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -173.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -144.8 135.15 24.27 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.242 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.5 m -116.98 139.04 51.14 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -134.72 152.13 51.52 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.797 0.332 . . . . 0.0 110.6 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.464 ' N ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -105.41 130.91 53.4 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.156 179.249 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 58.1 m -87.91 -168.52 2.24 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 39.3 tttp -124.51 131.47 53.49 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.407 HD13 ' H ' ' A' ' 31' ' ' GLY . 20.1 tt -106.45 118.14 55.36 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 121.014 0.435 . . . . 0.0 110.544 -179.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.28 -29.12 3.27 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.579 2.186 . . . . 0.0 112.91 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 62.1 m 66.52 12.66 8.87 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 122.849 0.459 . . . . 0.0 112.05 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -84.44 145.68 28.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.819 0.343 . . . . 0.0 110.402 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -77.2 99.95 5.62 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.212 0.529 . . . . 0.0 110.85 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -91.27 101.79 14.49 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.258 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -88.25 -96.63 0.09 Allowed 'General case' 0 CA--C 1.498 -1.02 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.249 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -172.56 124.67 0.48 Allowed 'General case' 0 N--CA 1.421 -1.924 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 -178.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -94.56 103.05 15.0 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.297 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 107.07 71.22 0.76 Allowed Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.153 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -129.65 -62.03 0.98 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.056 0.455 . . . . 0.0 110.382 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -83.69 -15.14 49.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.589 0.709 . . . . 0.0 109.525 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 9.9 p -153.81 -166.14 2.31 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 114.981 -1.009 . . . . 0.0 108.469 -177.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -132.01 147.36 52.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.499 ' CE2' HD22 ' A' ' 90' ' ' LEU . 48.5 m-85 -118.35 151.55 37.52 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-O 121.18 0.514 . . . . 0.0 111.899 -177.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.447 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 48.8 tp60 -114.76 117.66 31.39 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.033 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -96.58 141.55 29.71 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -119.03 162.39 18.64 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.099 0.476 . . . . 0.0 109.851 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.3 156.76 44.4 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.156 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -103.99 -11.53 17.36 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 165.12 -147.45 12.53 Favored Glycine 0 N--CA 1.428 -1.839 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -117.52 113.87 22.62 Favored 'General case' 0 N--CA 1.427 -1.589 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.869 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 14.9 t 60.77 118.25 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 O-C-N 124.049 0.843 . . . . 0.0 111.633 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -68.82 109.97 4.13 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.9 mt -69.33 -22.29 63.77 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.691 -174.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -66.69 -39.77 88.25 Favored 'General case' 0 N--CA 1.425 -1.675 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.203 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.8 p -107.82 -14.71 14.72 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 69.54 27.17 4.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 122.136 0.97 . . . . 0.0 108.998 -178.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 108' ' ' PRO . 22.6 mt -127.71 167.44 16.45 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-N 114.218 -1.356 . . . . 0.0 107.978 -178.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.536 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 27.7 ttpt -121.84 136.48 54.93 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.762 -177.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.6 m -120.1 145.33 47.0 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 115.175 -0.921 . . . . 0.0 111.565 -175.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -130.32 129.34 43.07 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 176.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.07 138.57 48.55 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.7 152.58 23.14 Favored Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.066 -178.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 23.0 t -145.66 146.02 31.14 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.026 0.441 . . . . 0.0 110.703 -179.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.594 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.0 tm? -68.11 123.06 19.61 Favored 'General case' 0 N--CA 1.406 -2.632 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.492 176.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.447 ' HD3' ' HB2' ' A' ' 70' ' ' GLN . 59.6 mtmt -85.75 -48.18 9.05 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 120.905 0.383 . . . . 0.0 110.715 -178.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -161.67 144.44 12.03 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.047 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -132.99 151.78 52.03 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.429 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tp -83.18 169.85 15.35 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -65.5 -27.4 68.45 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.586 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -105.13 45.74 0.95 Allowed 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.555 0.693 . . . . 0.0 109.41 177.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -150.34 115.16 5.28 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.059 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -103.37 117.24 34.03 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.563 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . 0.451 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 83.8 m -141.05 145.9 36.48 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.068 0.461 . . . . 0.0 111.582 -178.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.594 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 20.1 pm0 -66.76 150.08 49.63 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.377 175.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -76.72 -36.53 57.11 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.198 -173.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.42 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 5.4 t -152.57 149.53 28.58 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 119.296 -0.961 . . . . 0.0 113.378 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 17.0 m -136.39 140.64 43.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.94 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 11.0 t -128.85 136.69 50.81 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.507 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 12.9 tt -140.33 140.69 34.29 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 121.159 0.504 . . . . 0.0 111.249 -178.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 18.6 m -120.43 128.46 53.21 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.018 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -131.32 115.78 16.3 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.394 -179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.401 ' HA ' HD23 ' A' ' 83' ' ' LEU . 77.0 Cg_exo -51.26 127.63 22.73 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.524 2.149 . . . . 0.0 112.078 178.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.536 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 86.0 m -65.68 -50.22 65.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.806 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -175.42 131.65 1.98 Allowed Glycine 0 N--CA 1.438 -1.224 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.666 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -81.96 145.73 30.13 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.5 mp -53.99 126.85 24.07 Favored 'General case' 0 C--O 1.239 0.547 0 O-C-N 123.494 0.496 . . . . 0.0 111.563 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 7.4 p -79.82 169.91 17.26 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.48 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 61.33 71.61 0.77 Allowed Pre-proline 0 N--CA 1.467 0.396 0 O-C-N 123.408 0.442 . . . . 0.0 110.203 -177.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -57.36 -76.74 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.946 2.431 . . . . 0.0 113.063 -178.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp 41.09 62.99 6.25 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.269 0.628 . . . . 0.0 112.043 -176.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -52.17 141.05 49.83 Favored 'Trans proline' 0 C--N 1.362 1.269 0 C-N-CA 122.543 2.162 . . . . 0.0 111.264 176.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -62.67 118.55 7.8 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.325 0.583 . . . . 0.0 110.92 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -159.93 142.01 13.15 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.071 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.418 ' C ' ' H ' ' A' ' 122' ' ' LYS . 6.7 mp0 -60.98 122.13 14.15 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 177.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 39.6 m -77.56 35.04 0.18 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.14 0.495 . . . . 0.0 111.901 -176.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.418 ' H ' ' C ' ' A' ' 120' ' ' GLU . 94.0 mttt -124.62 162.12 24.79 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -77.92 90.2 4.13 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.136 0.493 . . . . 0.0 111.303 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -90.94 154.24 19.6 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.931 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt 66.88 99.15 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 O-C-N 123.76 0.663 . . . . 0.0 111.135 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -82.88 179.67 7.7 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.363 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -71.42 96.13 1.44 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.988 0.423 . . . . 0.0 111.672 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -85.14 45.67 3.55 Favored Glycine 0 N--CA 1.45 -0.408 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 176.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -142.58 156.03 45.06 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -177.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -157.29 92.82 1.27 Allowed 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 120.96 0.409 . . . . 0.0 110.142 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -78.93 105.29 10.16 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.175 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -60.8 -35.85 77.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.491 -177.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -147.06 159.82 43.13 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -75.61 127.0 32.11 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 64.1 tp 73.99 130.33 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 O-C-N 124.122 0.889 . . . . 0.0 111.14 -177.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 33.9 t70 . . . . . 0 C--O 1.255 1.362 0 C-N-CA 123.625 0.77 . . . . 0.0 111.317 -179.462 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.101 0 N-CA-C 111.928 -0.469 . . . . 0.0 111.928 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.418 ' NZ ' ' HB2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -141.83 17.49 2.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.708 0.254 . . . . 0.0 111.361 -179.608 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -81.66 156.11 25.26 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.824 0.345 . . . . 0.0 110.949 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -77.59 91.34 3.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.375 -177.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -149.32 93.52 4.09 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-O 121.013 0.435 . . . . 0.0 110.619 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -99.1 -136.66 0.01 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 123.5 2.8 . . . . 0.0 110.886 178.252 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -110.11 108.66 18.92 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.327 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -76.85 -21.67 54.66 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.2 tttt 64.08 121.55 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 114.524 -1.216 . . . . 0.0 113.257 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.3 p -85.26 151.96 3.68 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.772 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -85.78 43.89 1.07 Allowed 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.431 0.634 . . . . 0.0 111.265 -176.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -131.2 149.31 52.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.143 178.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 p -80.05 92.11 5.57 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.035 0.445 . . . . 0.0 110.24 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.85 106.77 17.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.135 -177.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.469 ' HA ' ' CB ' ' A' ' 40' ' ' THR . 1.3 m 59.96 91.9 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.586 176.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -134.48 177.58 19.1 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.495 -0.859 . . . . 0.0 113.067 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.504 ' CD ' ' H ' ' A' ' 17' ' ' GLU . 1.4 pm0 -85.45 170.66 12.46 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 123.791 0.836 . . . . 0.0 111.438 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.508 ' CD2' ' HB2' ' A' ' 39' ' ' ARG . 66.1 m95 -46.77 119.86 2.69 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.692 0.758 . . . . 0.0 112.888 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.44 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 93.5 mt-30 -116.1 115.12 25.5 Favored 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 175.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -101.13 146.55 27.33 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -175.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.0 t -91.98 174.98 7.04 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 114.53 -1.213 . . . . 0.0 109.334 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.9 m -93.13 153.46 3.33 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.325 -175.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.433 ' SG ' ' HD3' ' A' ' 35' ' ' ARG . 34.0 m -84.23 112.04 19.92 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.785 -176.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.467 ' O ' ' HA3' ' A' ' 33' ' ' GLY . 6.9 m -106.86 102.76 44.15 Favored Pre-proline 0 N--CA 1.435 -1.201 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 174.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.558 ' O ' ' HB ' ' A' ' 26' ' ' THR . 26.3 Cg_endo -62.18 -16.55 51.43 Favored 'Trans proline' 0 C--O 1.218 -0.484 0 C-N-CA 122.839 2.359 . . . . 0.0 112.553 -176.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.558 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 51.9 m 81.62 -14.53 0.79 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 122.544 1.164 . . . . 0.0 108.875 177.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.491 ' H ' ' C ' ' A' ' 25' ' ' PRO . 16.7 t -142.37 -145.46 0.17 Allowed 'General case' 0 N--CA 1.411 -2.414 0 CA-C-N 113.767 -1.561 . . . . 0.0 109.113 -178.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -151.93 -42.25 0.02 OUTLIER Glycine 0 CA--C 1.482 -2.023 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -102.98 66.54 0.92 Allowed 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.38 0.61 . . . . 0.0 110.797 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.2 m 75.29 76.43 0.1 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.463 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.463 ' O ' HD11 ' A' ' 55' ' ' ILE . . . -127.89 154.94 19.98 Favored Glycine 0 N--CA 1.44 -1.04 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 177.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.45 HD21 HH11 ' A' ' 52' ' ' ARG . 55.7 tp -83.76 125.42 31.89 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.739 0.269 . . . . 0.0 110.893 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.467 ' HA3' ' O ' ' A' ' 24' ' ' VAL . . . -139.17 164.74 25.83 Favored Glycine 0 CA--C 1.505 -0.564 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 -177.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 6.8 m -145.69 154.92 42.62 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -174.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.433 ' HD3' ' SG ' ' A' ' 23' ' ' CYS . 23.5 ptt180 -134.9 154.32 51.72 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.759 176.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -115.96 131.72 56.86 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.148 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -122.46 151.07 16.89 Favored Glycine 0 CA--C 1.52 0.357 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.506 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 14.2 p -134.32 155.03 50.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.429 0.614 . . . . 0.0 111.471 -177.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.525 ' HG2' ' N ' ' A' ' 40' ' ' THR . 17.5 ttt180 -151.49 160.47 43.69 Favored 'General case' 0 C--O 1.217 -0.609 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.525 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 0.2 OUTLIER -133.71 155.34 49.92 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 174.908 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -106.39 -152.11 19.35 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 111.095 -0.802 . . . . 0.0 111.095 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.58 -33.63 53.86 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 117.062 0.431 . . . . 0.0 111.649 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -84.94 1.68 46.25 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -177.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.452 ' HA ' HG21 ' A' ' 40' ' ' THR . 66.4 m 57.78 32.87 22.52 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.873 0.368 . . . . 0.0 111.422 -178.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -68.36 -23.54 64.7 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.312 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 72.25 105.46 0.07 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.635 0.731 . . . . 0.0 112.278 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 m -105.15 145.11 31.02 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.269 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 26.0 ttt -139.54 148.25 42.34 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.555 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -143.35 136.34 27.78 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.0 p -116.62 135.9 53.41 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 55.7 tp60 -137.86 138.24 38.9 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 120.364 -0.535 . . . . 0.0 111.386 -177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.45 HH11 HD21 ' A' ' 32' ' ' LEU . 39.6 mtt180 -87.37 131.5 34.26 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 85.4 m -82.36 160.64 22.77 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -113.69 135.38 54.0 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-O 121.259 0.552 . . . . 0.0 112.113 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.463 HD11 ' O ' ' A' ' 31' ' ' GLY . 4.0 mp -111.16 126.22 29.08 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.751 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -70.08 103.18 1.18 Allowed 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.487 2.125 . . . . 0.0 111.349 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 4.6 t -99.55 176.13 5.59 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.213 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -71.92 145.35 48.53 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.862 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.0 p90 -84.25 165.37 18.41 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.807 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -129.21 173.05 10.84 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.899 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.01 127.78 33.82 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.434 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -123.97 35.42 4.84 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.387 0.613 . . . . 0.0 109.813 -176.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -71.41 -17.19 62.41 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.378 -178.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.45 102.53 2.6 Favored Glycine 0 C--N 1.302 -1.314 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.243 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.5 -32.88 74.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.625 0.25 . . . . 0.0 111.625 -178.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -84.76 -13.4 51.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.968 0.413 . . . . 0.0 111.027 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 82.0 m -81.91 158.86 23.8 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.693 ' O ' ' HA ' ' A' ' 90' ' ' LEU . 47.6 mtpt -128.19 127.68 43.37 Favored 'General case' 0 CA--C 1.498 -1.025 0 C-N-CA 119.631 -0.828 . . . . 0.0 110.896 -176.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.427 ' CE2' ' HB2' ' A' ' 100' ' ' GLN . 79.0 m-85 -124.8 129.33 50.24 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.894 -175.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -112.07 129.75 56.11 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -94.14 135.7 35.24 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.979 0.419 . . . . 0.0 110.924 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.412 HE21 ' HB ' ' A' ' 87' ' ' THR . 7.1 pt20 -108.19 162.97 13.58 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.916 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.65 92.27 3.22 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.713 -177.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 43.0 p-90 -92.45 -18.07 23.71 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.525 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -167.27 110.77 0.41 Allowed Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.991 -0.843 . . . . 0.0 110.991 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -95.53 115.84 28.0 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-O 120.792 0.329 . . . . 0.0 111.774 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.553 ' H ' ' HG3' ' A' ' 84' ' ' LYS . 13.5 t 60.76 107.72 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.744 -1.116 . . . . 0.0 112.428 175.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.545 ' OD2' HG22 ' A' ' 81' ' ' THR . 27.3 t70 -82.16 131.16 35.24 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.789 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.8 mt -72.39 -32.41 66.37 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.559 -176.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -69.13 -42.42 76.04 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.288 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.57 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 10.0 t -105.99 -1.61 23.79 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -175.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 55.06 32.47 18.32 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 81' ' ' THR . 24.0 mt -127.1 164.33 21.82 Favored 'General case' 0 CA--C 1.497 -1.081 0 O-C-N 121.845 -0.535 . . . . 0.0 110.143 -178.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.553 ' HG3' ' H ' ' A' ' 77' ' ' CYS . 77.5 tttt -120.64 136.68 54.76 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -177.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 4.2 m -119.35 144.24 46.97 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.567 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -139.48 141.19 37.4 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.089 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.412 ' HB ' HE21 ' A' ' 72' ' ' GLN . 14.2 m -120.93 145.5 47.63 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.091 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -144.55 157.16 27.14 Favored Glycine 0 N--CA 1.443 -0.849 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.9 m -145.61 149.64 34.89 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.62 0.21 . . . . 0.0 111.206 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.693 ' HA ' ' O ' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -69.46 129.97 41.2 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.003 0.43 . . . . 0.0 110.219 177.595 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -92.65 -32.72 14.65 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 120.906 0.384 . . . . 0.0 110.91 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.94 143.93 31.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -134.65 145.46 48.6 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.71 0.291 . . . . 0.0 110.822 -176.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.7 mp -91.4 174.73 7.22 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.233 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -88.95 -17.25 29.88 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.105 0.478 . . . . 0.0 110.833 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -101.86 28.03 6.03 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.274 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -164.01 117.79 1.47 Allowed 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.983 -176.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -82.03 111.27 18.03 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 174.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 80.4 m -94.3 165.21 12.7 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.37 0.605 . . . . 0.0 112.262 -175.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' A' ' 90' ' ' LEU . 88.4 mt-30 -87.04 124.62 33.41 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.251 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.531 ' HA ' HD11 ' A' ' 90' ' ' LEU . 20.1 pttm -74.79 -31.96 61.88 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.412 -178.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.9 t -158.88 149.22 19.63 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-O 121.463 0.649 . . . . 0.0 111.389 175.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 13.7 m -141.5 139.47 32.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.063 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.5 m -129.04 131.67 47.38 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.108 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 22.4 pt -135.47 145.63 31.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 CA-C-O 120.625 0.25 . . . . 0.0 110.453 -177.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.405 ' HA ' ' O ' ' A' ' 84' ' ' LYS . 6.5 p -122.55 134.38 54.54 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.872 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -126.03 132.32 24.27 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.888 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.44 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 30.8 Cg_endo -64.03 124.47 13.56 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.049 1.833 . . . . 0.0 112.233 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 94.9 m -73.12 -17.85 61.35 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.235 0.541 . . . . 0.0 109.822 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -145.96 160.16 28.08 Favored Glycine 0 N--CA 1.433 -1.536 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.7 mttm 65.08 83.21 0.17 Allowed 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.646 0.736 . . . . 0.0 111.017 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 87.7 mt -81.18 97.49 7.62 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.59 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 10.9 p -94.05 154.55 17.57 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.316 -179.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 57.4 pttt 40.88 75.83 0.56 Allowed Pre-proline 0 N--CA 1.484 1.233 0 C-N-CA 124.169 0.987 . . . . 0.0 113.287 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -68.29 146.12 68.23 Favored 'Trans proline' 0 C--O 1.238 0.52 0 C-N-CA 122.666 2.244 . . . . 0.0 112.433 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -69.44 -47.5 26.52 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.069 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -79.46 88.6 1.43 Allowed 'Trans proline' 0 C--N 1.369 1.634 0 C-N-CA 121.947 1.765 . . . . 0.0 111.46 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -88.81 2.88 52.83 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.917 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 66.07 114.67 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.871 0.732 . . . . 0.0 111.75 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -76.71 84.94 3.34 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 121.136 0.493 . . . . 0.0 110.058 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 27.1 p -80.58 -6.84 58.87 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.312 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -61.01 121.24 11.93 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.464 178.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -65.23 -27.44 68.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.975 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 83.2 tttt 63.1 47.52 4.15 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.829 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt 61.09 50.18 5.15 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.786 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 97.3 mttt 66.26 -168.62 0.2 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.654 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -62.28 150.58 38.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.958 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -87.95 -61.6 1.49 Allowed Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.87 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -128.18 152.49 47.98 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.986 0.422 . . . . 0.0 110.825 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -110.27 88.08 2.67 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -121.46 129.42 52.96 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.866 -174.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 49.09 15.46 0.11 Allowed 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 125.431 1.493 . . . . 0.0 115.003 175.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.7 mttm 62.04 -178.32 0.13 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.282 0.563 . . . . 0.0 111.219 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 65.9 mtt -91.1 101.8 14.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.945 0.402 . . . . 0.0 109.95 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 94.4 mt -97.4 -176.31 3.47 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.375 -179.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.416 -0.802 . . . . 0.0 109.582 178.327 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.246 0 N-CA-C 111.766 -0.534 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -89.49 4.75 48.18 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -177.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -65.43 -27.87 68.83 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.547 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 60.96 -172.22 0.14 Allowed 'General case' 0 C--O 1.239 0.505 0 O-C-N 123.426 0.454 . . . . 0.0 110.59 -176.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.1 mttm 48.79 79.89 0.32 Allowed Pre-proline 0 N--CA 1.471 0.582 0 C-N-CA 123.61 0.764 . . . . 0.0 112.718 175.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.423 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 0.3 OUTLIER -93.16 -140.15 0.02 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 122.875 2.383 . . . . 0.0 110.536 178.573 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.423 ' H ' ' HB2' ' A' ' 6' ' ' PRO . 39.1 mt-10 -107.41 39.08 1.97 Allowed 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.299 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 mttp 54.5 26.18 6.93 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.563 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -65.9 126.81 29.7 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.436 -178.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.9 p -93.96 165.61 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.799 177.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -84.84 164.03 18.69 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.24 -179.5 3.39 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.231 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.1 m -52.45 95.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -176.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -115.12 135.14 54.52 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.014 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.3 p -109.6 19.58 19.07 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -178.53 131.29 1.7 Allowed Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.034 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -107.83 164.55 12.15 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -56.98 123.55 15.54 Favored 'General case' 0 N--CA 1.427 -1.592 0 O-C-N 123.528 0.518 . . . . 0.0 111.109 173.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.556 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 74.3 mt-30 -115.95 115.45 26.19 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -104.26 143.61 32.73 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 t -104.38 171.59 7.25 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.87 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.8 m -94.61 154.82 3.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.6 t -56.16 114.15 1.84 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.325 -178.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 10.5 m -109.99 120.81 43.63 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.989 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.97 129.58 19.87 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 122.786 2.324 . . . . 0.0 113.731 -177.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.514 ' HB ' ' O ' ' A' ' 32' ' ' LEU . 94.9 m -77.75 -22.51 50.17 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.227 176.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.558 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 17.9 t -159.71 116.91 2.62 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.65 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.9 -32.73 80.79 Favored Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.746 -0.661 . . . . 0.0 113.088 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -76.38 52.68 0.79 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.566 0.222 . . . . 0.0 111.371 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.419 ' HA ' HD12 ' A' ' 55' ' ' ILE . 42.5 t 65.95 80.98 0.21 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.141 179.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.558 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -148.87 157.11 27.14 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.3 -0.952 . . . . 0.0 114.191 -177.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.514 ' O ' ' HB ' ' A' ' 26' ' ' THR . 4.3 mm? -49.26 158.42 0.38 Allowed 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 124.465 1.106 . . . . 0.0 112.459 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.1 176.71 19.85 Favored Glycine 0 N--CA 1.434 -1.496 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -178.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.4 p -140.35 156.19 46.51 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 118.24 1.02 . . . . 0.0 113.049 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 70.9 mtt-85 -135.62 138.47 42.94 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.749 -1.114 . . . . 0.0 108.542 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -124.85 131.31 53.45 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 120.858 0.361 . . . . 0.0 111.583 -177.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.556 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -133.42 137.33 9.27 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.6 p -132.04 152.8 50.96 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 117.439 0.619 . . . . 0.0 111.083 -177.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.4 ' HG2' ' N ' ' A' ' 40' ' ' THR . 68.7 ttt180 -155.17 160.77 41.16 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.4 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 6.2 p -117.88 161.85 19.08 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -81.11 -173.03 47.15 Favored Glycine 0 C--N 1.322 -0.248 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.222 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.79 -33.47 72.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.983 0.42 . . . . 0.0 110.983 -178.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -97.7 18.12 16.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.497 0.665 . . . . 0.0 109.414 176.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 72.4 m 69.06 60.04 0.34 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.954 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HG3' ' H ' ' A' ' 46' ' ' GLN . 14.4 tptm -77.6 -145.87 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.814 176.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.412 ' H ' ' HG3' ' A' ' 45' ' ' LYS . 52.2 tt0 -150.1 116.09 5.64 Favored 'General case' 0 N--CA 1.412 -2.342 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 -178.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.0 m -133.47 122.18 23.28 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 57.0 mtm -129.0 134.97 48.36 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.912 0.387 . . . . 0.0 111.114 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -132.25 130.33 40.79 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.541 177.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 p -130.8 131.3 44.58 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 176.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -124.93 141.97 51.77 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 121.105 0.478 . . . . 0.0 110.231 -176.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -85.45 110.72 19.37 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 122.451 1.12 . . . . 0.0 112.232 -177.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.2 t -68.66 147.23 52.18 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 113.063 -1.88 . . . . 0.0 109.867 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.0 tttm -114.07 142.14 46.57 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-O 120.753 0.311 . . . . 0.0 110.552 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.419 HD12 ' HA ' ' A' ' 30' ' ' CYS . 17.9 tt -97.91 130.89 27.76 Favored Pre-proline 0 C--N 1.308 -1.197 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -51.0 -52.65 8.64 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.974 2.449 . . . . 0.0 112.242 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 6.3 t 70.73 177.08 0.27 Allowed 'General case' 0 CA--C 1.536 0.44 0 O-C-N 123.764 0.665 . . . . 0.0 110.886 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -84.27 138.29 33.01 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.445 -178.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.1 m95 46.04 65.87 1.07 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.95 0.781 . . . . 0.0 111.383 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.3 pttt -90.8 142.86 27.32 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.953 -177.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -103.96 135.52 45.33 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 172.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -153.26 15.4 0.53 Allowed 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 121.748 0.785 . . . . 0.0 109.742 -174.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -98.59 93.19 5.99 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.517 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -83.37 -15.38 71.66 Favored Glycine 0 C--N 1.314 -0.664 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.634 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 62.55 15.69 8.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.047 0.539 . . . . 0.0 111.719 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -84.25 -5.63 59.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.363 0.601 . . . . 0.0 110.293 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 50.0 m -136.52 -160.68 1.08 Allowed 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -127.11 137.05 52.92 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.047 0.385 . . . . 0.0 110.134 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.404 ' HE2' ' HB2' ' A' ' 90' ' ' LEU . 12.5 m-85 -123.26 150.24 43.75 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.995 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.9 tm0? -125.51 125.43 43.25 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -94.18 131.43 39.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.199 0.523 . . . . 0.0 112.141 -176.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -97.25 163.79 12.76 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.84 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -126.66 79.32 1.86 Allowed 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.109 -178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 42.2 t-105 -82.32 -26.31 33.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.238 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -143.78 157.14 26.95 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.574 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -96.32 147.92 23.3 Favored 'General case' 0 N--CA 1.437 -1.113 0 C-N-CA 123.167 0.587 . . . . 0.0 110.15 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 40.5 t -30.63 137.38 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 O-C-N 124.203 0.939 . . . . 0.0 111.428 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -77.85 122.04 24.92 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 121.516 0.674 . . . . 0.0 109.841 -176.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.8 mt -70.7 -33.12 70.55 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 114.609 -1.178 . . . . 0.0 112.091 -173.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -71.67 -37.49 70.76 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.496 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.513 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 68.1 p -104.32 -8.01 19.57 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -172.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 57.27 34.5 24.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.275 0.56 . . . . 0.0 110.528 -175.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 81' ' ' THR . 44.1 mt -126.98 147.3 50.12 Favored 'General case' 0 CA--C 1.496 -1.11 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.094 -178.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.737 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 81.4 tttt -124.77 137.26 54.33 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.703 -178.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 52.3 m -119.12 143.76 47.0 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 -134.73 140.55 46.03 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.0 m -109.81 143.72 39.26 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -136.39 167.28 24.52 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 120.462 -0.875 . . . . 0.0 111.393 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.8 p -135.22 144.28 46.83 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 120.626 0.25 . . . . 0.0 110.7 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.577 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 2.9 tm? -70.76 122.87 20.66 Favored 'General case' 0 N--CA 1.409 -2.492 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -97.35 -37.54 9.99 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.957 0.408 . . . . 0.0 110.853 -177.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -155.64 135.06 12.4 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.234 178.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -126.18 144.78 50.63 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 42.9 mt -87.24 174.39 8.62 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.394 0.616 . . . . 0.0 111.535 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -73.64 -26.7 60.89 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.48 -178.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -105.05 35.94 2.64 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.613 0.72 . . . . 0.0 109.495 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -154.11 134.57 13.47 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.921 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -112.31 122.46 47.79 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 70.7 m -139.72 141.31 36.92 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.205 0.526 . . . . 0.0 111.599 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.577 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 3.0 pm0 -68.72 154.27 42.26 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.81 176.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.4 pttm -74.07 -26.55 60.45 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.555 -175.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.5 t -140.63 150.95 44.2 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.324 -0.55 . . . . 0.0 111.665 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 15.8 m -138.87 149.48 23.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.24 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 97.2 m -129.24 136.61 50.33 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.42 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tt -140.7 141.31 32.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 120.84 0.352 . . . . 0.0 110.614 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 57.6 m -121.16 134.8 55.23 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -134.27 133.94 22.24 Favored Pre-proline 0 C--N 1.313 -0.983 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.429 -178.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.446 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 32.7 Cg_exo -58.12 131.03 40.93 Favored 'Trans proline' 0 C--O 1.244 0.777 0 C-N-CA 121.924 1.75 . . . . 0.0 111.504 175.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.737 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 69.8 m -81.77 173.55 12.18 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.325 0.583 . . . . 0.0 111.576 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 168.18 -147.9 12.03 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -87.69 77.47 8.66 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.669 0.747 . . . . 0.0 110.635 178.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -131.98 166.58 21.36 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.186 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' THR . . . . . 0.448 ' O ' ' HD3' ' A' ' 115' ' ' PRO . 13.5 p -82.39 -178.35 7.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.3 177.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -114.48 86.32 12.24 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-O 120.725 0.297 . . . . 0.0 110.775 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 113' ' ' THR . 33.7 Cg_exo -63.82 136.56 53.89 Favored 'Trans proline' 0 C--O 1.24 0.615 0 C-N-CA 122.754 2.302 . . . . 0.0 113.271 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.532 ' N ' ' HD3' ' A' ' 117' ' ' PRO . 19.2 pttp -155.49 53.8 0.88 Allowed Pre-proline 0 C--N 1.306 -1.313 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.233 175.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.532 ' HD3' ' N ' ' A' ' 116' ' ' LYS . 42.0 Cg_exo -56.89 102.3 0.11 Allowed 'Trans proline' 0 C--N 1.372 1.776 0 C-N-CA 122.731 2.288 . . . . 0.0 113.366 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 68.97 127.77 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 177.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -135.64 115.92 13.5 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.548 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.455 ' HB3' ' HB2' ' A' ' 123' ' ' LYS . 29.7 mt-10 -67.64 108.18 2.81 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.846 0.355 . . . . 0.0 110.819 -178.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 12.0 m -96.87 -24.55 15.82 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.074 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -92.47 -28.4 16.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.952 -179.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 120' ' ' GLU . 40.9 mmtm -85.83 88.2 7.52 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.176 0.512 . . . . 0.0 110.211 177.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -82.83 -42.38 17.91 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.362 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 54.3 tptt 60.84 -78.4 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.803 0.841 . . . . 0.0 112.003 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 57.4 tttp 62.87 -79.43 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.885 0.874 . . . . 0.0 110.519 -176.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 66.18 168.7 0.22 Allowed 'General case' 0 C--O 1.237 0.441 0 C-N-CA 123.926 0.89 . . . . 0.0 112.658 176.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -167.76 -96.27 0.11 Allowed Glycine 0 N--CA 1.433 -1.532 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 178.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 58.8 mttp 50.07 78.03 0.11 Allowed 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.076 0.55 . . . . 0.0 112.342 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -69.93 87.95 0.56 Allowed 'General case' 0 N--CA 1.434 -1.273 0 CA-C-O 121.158 0.504 . . . . 0.0 109.753 177.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -55.8 -64.16 0.94 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.806 -178.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -157.07 131.25 8.42 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.473 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp -153.03 72.2 0.94 Allowed 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 28.0 ttt -80.27 128.8 33.96 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.553 -177.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 50.1 tp -140.06 102.66 4.44 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 C--N 1.311 -1.102 0 CA-C-O 118.287 -0.863 . . . . 0.0 111.354 -175.883 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.947 0 N-CA-C 111.459 -0.657 . . . . 0.0 111.459 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -113.92 -178.68 3.43 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.697 0.284 . . . . 0.0 110.51 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 4' ' ' GLU . 20.9 pttp -149.7 19.13 0.91 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.911 -176.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.459 ' HB3' ' O ' ' A' ' 3' ' ' LYS . 39.4 tt0 71.28 132.14 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -172.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 66.1 tttp 62.28 81.41 0.23 Allowed Pre-proline 0 C--O 1.238 0.46 0 CA-C-O 121.218 0.532 . . . . 0.0 109.66 -176.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.429 ' HG2' ' H ' ' A' ' 7' ' ' GLU . 59.8 Cg_endo -73.78 -88.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.512 -0.616 0 C-N-CA 122.731 2.287 . . . . 0.0 113.034 -178.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.429 ' H ' ' HG2' ' A' ' 6' ' ' PRO . 39.5 mt-10 60.42 68.58 0.75 Allowed 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.09 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -143.06 118.13 10.07 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.23 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -82.92 130.19 35.11 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.397 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 p -119.88 142.22 36.41 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.394 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.742 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.0 mtpt -127.89 153.01 47.14 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.653 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -88.42 100.84 13.34 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.8 m -150.66 -159.81 1.08 Allowed 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.548 -177.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -76.1 165.57 24.73 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.2 m 57.71 87.34 0.07 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.172 0.511 . . . . 0.0 110.907 -176.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -147.06 179.02 24.31 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.878 -177.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -76.2 169.66 17.79 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 122.93 0.492 . . . . 0.0 111.253 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.51 ' CD2' ' HB2' ' A' ' 39' ' ' ARG . 81.6 m95 -48.57 118.93 2.75 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.417 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.438 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 6.8 pt20 -120.14 115.44 23.66 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 89.7 m95 -100.8 146.41 27.32 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.803 -175.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 m -94.53 171.8 8.58 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 114.79 -1.095 . . . . 0.0 108.998 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.5 m -91.93 154.79 3.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -177.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.8 t -74.45 116.47 15.16 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.805 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.0 t -111.44 117.87 48.39 Favored Pre-proline 0 N--CA 1.434 -1.246 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 179.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.32 143.66 75.26 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.533 2.155 . . . . 0.0 112.373 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.485 ' HB ' ' O ' ' A' ' 32' ' ' LEU . 23.7 m -90.3 -23.8 21.06 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.354 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.4 t -134.62 173.63 11.45 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.074 179.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.94 74.57 0.25 Allowed Glycine 0 N--CA 1.448 -0.565 0 O-C-N 123.683 0.614 . . . . 0.0 113.617 -177.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.7 t70 68.93 23.87 6.56 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-O 121.9 0.857 . . . . 0.0 110.826 174.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.488 ' HA ' ' HB2' ' A' ' 57' ' ' CYS . 9.0 t -150.92 10.35 0.61 Allowed 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.619 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.473 ' O ' HG13 ' A' ' 55' ' ' ILE . . . -126.51 126.1 5.62 Favored Glycine 0 CA--C 1.494 -1.229 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.539 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.485 ' O ' ' HB ' ' A' ' 26' ' ' THR . 1.2 mp -51.64 152.4 2.81 Favored 'General case' 0 C--O 1.207 -1.158 0 O-C-N 124.176 0.574 . . . . 0.0 111.483 -179.028 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.07 -175.19 14.79 Favored Glycine 0 CA--C 1.496 -1.154 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 -173.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.2 p -136.8 154.14 50.62 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 117.816 0.808 . . . . 0.0 112.207 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -126.23 137.63 53.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 175.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -113.9 131.41 56.3 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.569 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.438 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -137.7 141.7 12.51 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.487 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 22.8 p -123.79 154.78 39.06 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.954 0.377 . . . . 0.0 110.658 -179.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.51 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 9.4 tpt180 -145.18 159.95 42.21 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.412 ' N ' ' HG3' ' A' ' 39' ' ' ARG . 11.1 t -115.84 162.22 17.63 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-O 122.173 0.987 . . . . 0.0 112.225 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.41 -164.15 11.23 Favored Glycine 0 C--N 1.286 -2.24 0 CA-C-N 113.432 -1.713 . . . . 0.0 108.839 175.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.17 -25.97 66.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 118.254 1.027 . . . . 0.0 111.872 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -99.73 -11.34 20.94 Favored 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 120.182 -0.607 . . . . 0.0 111.364 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.404 ' HA ' ' OG1' ' A' ' 40' ' ' THR . 93.8 m 68.29 152.17 0.09 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptp 63.25 10.8 4.9 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.832 175.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -103.57 18.12 22.57 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.408 ' HB ' ' O ' ' A' ' 39' ' ' ARG . 11.9 m -143.62 110.44 5.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.549 0.69 . . . . 0.0 112.01 178.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 24.2 ttt -146.23 135.11 22.46 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.045 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -143.05 142.76 31.64 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.12 0.486 . . . . 0.0 111.397 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.1 m -118.4 136.58 53.68 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.08 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -128.73 141.19 51.4 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 110.264 -0.272 . . . . 0.0 110.264 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 84.1 mtt180 -86.91 139.49 30.58 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.434 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 1.5 p -99.96 -170.18 1.85 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -113.49 138.42 50.15 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.655 0.264 . . . . 0.0 110.75 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 31' ' ' GLY . 22.0 mm -126.69 111.15 22.63 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.273 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.76 122.92 9.59 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.569 2.179 . . . . 0.0 111.411 177.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.488 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 42.6 t -124.34 157.08 35.86 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.663 0.268 . . . . 0.0 110.986 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -67.28 146.76 53.81 Favored 'General case' 0 C--O 1.244 0.783 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.245 177.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -59.71 153.4 20.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.262 0.553 . . . . 0.0 112.05 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -92.37 -164.66 1.21 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.549 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.409 ' HD2' ' N ' ' A' ' 61' ' ' LYS . 9.8 mptt -84.4 141.99 30.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.796 -178.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -144.26 100.45 3.55 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -109.65 18.15 20.57 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.11 0.481 . . . . 0.0 111.262 -177.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 139.89 171.95 12.56 Favored Glycine 0 N--CA 1.445 -0.727 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.457 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.06 -56.89 2.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.017 0.436 . . . . 0.0 110.596 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -89.17 -19.72 25.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.879 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 99.0 m -80.72 116.52 20.77 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.539 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -112.98 130.33 56.17 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.681 ' CE1' HD21 ' A' ' 90' ' ' LEU . 4.6 m-85 -106.58 152.36 23.82 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.374 -177.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.433 ' O ' ' HA2' ' A' ' 88' ' ' GLY . 6.4 tp-100 -103.34 117.05 33.61 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 174.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -94.52 118.74 32.14 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -175.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -122.34 162.97 20.55 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.373 177.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.52 141.63 28.47 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-O 120.972 0.415 . . . . 0.0 111.037 -176.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 40.6 t-105 -97.65 -5.3 35.67 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 148.85 -170.57 29.25 Favored Glycine 0 N--CA 1.427 -1.94 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.873 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -95.68 148.48 22.5 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 124.04 0.936 . . . . 0.0 109.09 179.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 13.8 m -22.98 125.18 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.358 0 O-C-N 124.225 0.953 . . . . 0.0 112.447 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -80.33 120.46 24.41 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.1 mt -70.22 -28.33 65.18 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.304 -0.862 . . . . 0.0 112.302 -174.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -70.7 -37.38 73.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.029 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.606 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.5 p -105.37 -9.41 17.59 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -174.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.98 25.72 14.16 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.422 0.689 . . . . 0.0 110.972 -175.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 81' ' ' THR . 13.9 mt -126.86 162.41 25.95 Favored 'General case' 0 CA--C 1.5 -0.968 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.49 -177.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.614 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 34.9 ttpt -118.93 147.84 43.59 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.1 m -119.27 142.48 48.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.841 0.353 . . . . 0.0 110.479 -176.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.0 tpt180 -135.22 141.03 45.73 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -178.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.7 m -118.43 144.69 45.78 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.486 -178.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.433 ' HA2' ' O ' ' A' ' 70' ' ' GLN . . . -136.29 150.28 20.4 Favored Glycine 0 N--CA 1.435 -1.379 0 C-N-CA 120.195 -1.002 . . . . 0.0 111.938 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 25.8 m -127.36 134.29 49.97 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 120.981 0.419 . . . . 0.0 111.903 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.681 HD21 ' CE1' ' A' ' 69' ' ' TYR . 2.8 tm? -74.4 127.49 33.16 Favored 'General case' 0 N--CA 1.427 -1.62 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.235 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -86.77 -50.75 6.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.567 -177.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -144.08 142.02 30.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.83 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.402 ' HB3' HD12 ' A' ' 90' ' ' LEU . . . -135.18 140.02 45.02 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.7 mp -89.12 175.92 7.18 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 120.915 0.388 . . . . 0.0 110.582 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -83.23 0.52 45.16 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.909 0.385 . . . . 0.0 111.578 -176.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -101.19 15.14 29.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.162 0.506 . . . . 0.0 110.339 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -173.9 123.64 0.34 Allowed 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.04 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -93.58 110.14 21.75 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.331 0.586 . . . . 0.0 109.654 177.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 75.7 m -109.91 133.05 53.59 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.114 -177.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -66.96 150.81 48.71 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.01 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -74.82 -29.63 61.13 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.939 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.7 t -146.05 150.06 35.27 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.766 0.793 . . . . 0.0 112.263 178.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 28.7 m -135.49 146.87 29.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.316 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 95.8 m -128.43 127.68 43.0 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 13.5 tt -136.02 148.62 27.65 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 CA-C-O 120.818 0.342 . . . . 0.0 110.611 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.4 ' HA ' ' O ' ' A' ' 84' ' ' LYS . 54.6 m -130.3 135.68 48.34 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.097 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -133.26 148.59 69.68 Favored Pre-proline 0 C--N 1.319 -0.745 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.876 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . 0.514 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 34.4 Cg_exo -59.63 131.98 43.16 Favored 'Trans proline' 0 CA--C 1.516 -0.408 0 C-N-CA 122.63 2.22 . . . . 0.0 113.022 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.614 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 78.8 m -75.31 -17.02 60.37 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.349 0.595 . . . . 0.0 109.938 176.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -124.48 -139.11 5.24 Favored Glycine 0 N--CA 1.439 -1.105 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.438 ' HG2' ' H ' ' A' ' 112' ' ' LEU . 75.1 tttt 66.58 175.84 0.24 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 122.415 0.286 . . . . 0.0 110.723 177.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.438 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 9.9 mp 71.25 167.46 0.31 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.528 0.731 . . . . 0.0 111.501 178.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.1 p -78.41 116.24 18.69 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.842 179.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.526 ' HB3' ' HD3' ' A' ' 115' ' ' PRO . 40.0 ttmt -135.16 -48.59 0.02 OUTLIER Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.618 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . 0.526 ' HD3' ' HB3' ' A' ' 114' ' ' LYS . 31.4 Cg_exo -68.56 -139.17 0.01 OUTLIER 'Trans proline' 0 C--N 1.375 1.968 0 C-N-CA 121.992 1.795 . . . . 0.0 112.245 175.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 65.6 tttp 62.55 63.13 1.91 Allowed Pre-proline 0 N--CA 1.446 -0.655 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.065 -177.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -42.16 117.96 0.89 Allowed 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 123.521 2.814 . . . . 0.0 111.839 176.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -88.0 93.0 9.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.244 0.545 . . . . 0.0 111.7 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -94.45 78.22 3.86 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.765 177.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -90.69 26.16 2.12 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.029 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 7.2 m -70.65 -23.71 62.57 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.612 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.1 mmtm 70.7 -68.01 0.23 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.882 0.873 . . . . 0.0 111.261 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -140.09 153.81 46.85 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.009 178.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -89.04 -35.78 16.16 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 176.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -122.71 98.96 6.15 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.254 176.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -65.19 -48.47 73.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.095 0.474 . . . . 0.0 110.841 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -150.49 -169.45 3.39 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.432 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 138.33 70.47 0.05 OUTLIER Glycine 0 N--CA 1.441 -1.009 0 C-N-CA 120.19 -1.005 . . . . 0.0 112.154 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -101.96 142.0 33.92 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -82.69 60.2 5.14 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.25 -179.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 63.52 -178.13 0.15 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.443 0.64 . . . . 0.0 111.477 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -108.72 161.7 14.85 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.367 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -88.67 157.11 18.65 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.967 0.413 . . . . 0.0 111.23 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 95.9 mmm -87.28 133.53 33.67 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.682 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -84.46 158.7 20.95 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 -177.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 C--O 1.248 1.007 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.298 -179.545 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.305 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -159.7 179.33 8.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.609 0.243 . . . . 0.0 110.356 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -89.03 86.0 6.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.996 0.427 . . . . 0.0 110.092 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -99.85 159.68 14.89 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.113 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -66.18 128.36 93.79 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.881 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -61.48 -153.65 0.02 OUTLIER 'Trans proline' 0 CA--C 1.504 -0.983 0 C-N-CA 123.643 2.895 . . . . 0.0 114.22 175.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -106.16 55.65 0.67 Allowed 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 112.941 -1.936 . . . . 0.0 111.172 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp 50.46 86.4 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.616 -179.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -115.25 172.12 7.27 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 120.883 0.373 . . . . 0.0 111.402 -178.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -152.48 157.48 4.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.134 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.3 mttp -98.45 160.65 14.14 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.009 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -60.1 109.82 1.06 Allowed 'General case' 0 N--CA 1.439 -1.011 0 CA-C-O 121.09 0.471 . . . . 0.0 111.256 -179.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.8 m -109.4 119.59 39.93 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.415 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -107.26 151.42 25.47 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.936 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 75.9 m 55.35 81.62 0.11 Allowed 'General case' 0 C--O 1.234 0.264 0 O-C-N 123.725 0.641 . . . . 0.0 110.207 -178.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -144.19 -178.98 20.34 Favored Glycine 0 N--CA 1.441 -0.997 0 C-N-CA 120.303 -0.951 . . . . 0.0 114.115 -174.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -73.97 167.95 20.48 Favored 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 123.915 0.886 . . . . 0.0 111.816 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -49.4 125.14 10.52 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 114.648 -1.16 . . . . 0.0 112.159 178.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -115.5 123.06 47.57 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -102.83 133.11 48.45 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.167 0.508 . . . . 0.0 111.781 -175.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.9 p -96.11 170.09 9.51 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.654 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.3 m -87.23 131.01 36.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 122.494 1.14 . . . . 0.0 111.555 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.473 ' HB2' ' HB2' ' A' ' 35' ' ' ARG . 50.9 t -81.15 135.85 35.83 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 112.947 -1.933 . . . . 0.0 112.779 -175.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.478 ' O ' ' HA3' ' A' ' 33' ' ' GLY . 57.5 t -100.44 100.65 12.59 Favored Pre-proline 0 N--CA 1.438 -1.054 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 171.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.567 ' O ' ' HB ' ' A' ' 26' ' ' THR . 72.3 Cg_endo -74.89 0.92 8.25 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.782 2.321 . . . . 0.0 113.361 -174.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.567 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 17.0 m 80.9 -39.09 0.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.794 0.438 . . . . 0.0 110.611 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.1 t 75.21 179.56 0.19 Allowed 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.616 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.21 8.05 48.15 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.023 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 64.09 10.01 5.1 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.428 0.691 . . . . 0.0 111.577 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 59.2 m -159.14 30.55 0.21 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -109.14 140.11 15.52 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 119.898 -1.144 . . . . 0.0 113.443 -174.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 53' ' ' CYS . 47.6 tp -100.52 127.04 47.0 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 176.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' A' ' 24' ' ' VAL . . . -126.7 -173.49 13.55 Favored Glycine 0 C--N 1.316 -0.544 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 p -137.02 153.32 50.67 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 118.893 1.346 . . . . 0.0 112.986 -178.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.473 ' HB2' ' HB2' ' A' ' 23' ' ' CYS . 45.3 ttm180 -131.57 137.91 48.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.614 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -115.35 130.41 56.89 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 120.679 0.276 . . . . 0.0 111.029 -178.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -127.88 135.71 8.82 Favored Glycine 0 N--CA 1.435 -1.405 0 N-CA-C 109.038 -1.625 . . . . 0.0 109.038 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 29.8 m -129.06 148.48 51.01 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 117.964 0.882 . . . . 0.0 110.361 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -142.63 162.03 36.53 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.78 145.21 33.03 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -101.65 -158.52 26.73 Favored Glycine 0 N--CA 1.437 -1.235 0 C-N-CA 120.069 -1.062 . . . . 0.0 112.155 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.18 -31.54 72.01 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.15 0.5 . . . . 0.0 110.325 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 27.9 mm-40 -89.49 2.45 54.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.831 178.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 35.89 59.37 0.88 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -174.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 74.5 mmtt -128.62 143.43 50.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.884 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.514 ' HG3' ' H ' ' A' ' 47' ' ' THR . 18.7 pt20 36.02 -108.7 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.575 1.15 . . . . 0.0 113.886 -178.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.514 ' H ' ' HG3' ' A' ' 46' ' ' GLN . 3.0 p 46.35 45.59 13.4 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.891 0.876 . . . . 0.0 113.189 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -125.48 138.34 53.99 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.808 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -136.18 143.75 44.6 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 121.011 0.434 . . . . 0.0 110.385 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 16.6 p -117.65 137.46 52.63 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 66.5 mm-40 -122.24 151.81 40.67 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -177.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.8 mtm180 -107.92 126.98 53.33 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 176.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.465 ' O ' HD13 ' A' ' 32' ' ' LEU . 36.3 m -88.32 125.23 34.58 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -111.85 138.87 47.87 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 121.124 0.488 . . . . 0.0 112.041 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.1 mm -114.19 106.05 53.43 Favored Pre-proline 0 N--CA 1.436 -1.148 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -64.67 100.44 0.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.187 1.924 . . . . 0.0 111.358 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.8 t -72.64 -34.05 67.04 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.897 -178.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -71.44 145.22 49.4 Favored 'General case' 0 C--O 1.246 0.877 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.677 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 1.6 p90 -55.36 116.97 3.14 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.293 0.568 . . . . 0.0 110.094 176.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 15.3 mtmm -78.5 -80.89 0.11 Allowed 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.368 -175.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 31.9 ttmt 55.48 25.62 8.02 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.454 0.645 . . . . 0.0 111.211 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -132.28 30.82 4.16 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.505 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -66.79 97.81 0.49 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.43 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.566 ' HA3' ' CG ' ' A' ' 69' ' ' TYR . . . 66.67 18.5 68.21 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.643 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.71 -13.51 48.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 0.0 110.743 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -88.96 -5.26 58.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.397 0.618 . . . . 0.0 109.706 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 10.1 p -147.44 -118.08 0.07 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.703 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 92' ' ' ARG . 62.9 mttp -133.38 125.9 30.13 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 122.204 -0.31 . . . . 0.0 110.453 178.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.566 ' CG ' ' HA3' ' A' ' 64' ' ' GLY . 0.3 OUTLIER -130.94 152.9 49.76 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.174 0.511 . . . . 0.0 111.877 -175.997 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -103.27 118.43 36.76 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.22 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -97.6 114.62 26.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -175.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.434 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 6.6 tt0 -123.63 136.83 54.72 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.636 175.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 57.08 36.32 27.5 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.545 0.688 . . . . 0.0 111.179 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -86.62 -23.9 25.54 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.718 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.03 -88.36 0.08 OUTLIER Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 116.054 1.181 . . . . 0.0 116.054 -175.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -117.47 143.88 45.59 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -169.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 8.4 t -69.8 159.32 33.81 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.759 175.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -94.32 115.91 28.2 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-O 121.354 0.597 . . . . 0.0 111.108 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -71.16 -30.61 66.66 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.958 -178.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -66.9 -33.26 75.2 Favored 'General case' 0 CA--C 1.496 -1.113 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.165 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.499 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 67.8 p -107.72 -8.33 16.11 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.045 -177.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.435 ' O ' HD21 ' A' ' 83' ' ' LEU . . . 59.1 38.3 23.91 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.419 -175.136 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 81' ' ' THR . 81.0 mt -130.02 148.84 51.92 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.488 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.751 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 60.6 tttp -127.05 135.53 50.92 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.649 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -139.37 145.78 39.41 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.71 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -136.44 130.06 32.08 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.896 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.434 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 4.0 m -120.87 143.69 48.78 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.309 -179.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -149.84 152.34 24.28 Favored Glycine 0 N--CA 1.436 -1.356 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.899 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.8 m -146.12 144.19 29.83 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.379 -0.411 . . . . 0.0 111.58 177.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.654 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 4.9 tt -72.26 122.45 21.12 Favored 'General case' 0 N--CA 1.432 -1.365 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 176.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.463 ' HE2' ' O ' ' A' ' 69' ' ' TYR . 46.1 pttt -104.93 -12.58 16.15 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -178.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.519 ' HB2' ' HB2' ' A' ' 68' ' ' LYS . 21.2 mmt180 -150.94 134.19 16.12 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -111.17 132.64 54.15 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.411 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.413 ' HB2' ' HB2' ' A' ' 97' ' ' ALA . 10.3 mp -94.47 152.61 18.44 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.004 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -76.82 -10.37 59.33 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.95 0.405 . . . . 0.0 111.288 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -125.07 19.93 8.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.281 0.563 . . . . 0.0 111.05 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.413 ' HB2' ' HB2' ' A' ' 94' ' ' LEU . . . -156.23 112.25 3.03 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.701 -178.068 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -91.32 110.97 22.27 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . 0.438 ' HB2' ' CD1' ' A' ' 90' ' ' LEU . 91.2 m -101.53 162.64 12.75 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.65 0.738 . . . . 0.0 112.863 -177.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.654 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 3.1 pt20 -66.77 130.49 43.35 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.075 -1.421 . . . . 0.0 108.91 176.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.455 ' HA ' ' HB3' ' A' ' 90' ' ' LEU . 29.0 tptp -76.72 -44.97 31.24 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.173 -174.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.9 t -151.34 153.05 34.03 Favored 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 119.862 -0.735 . . . . 0.0 111.689 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 m -143.71 136.7 24.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.953 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 89.2 m -130.83 124.25 30.87 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.423 175.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.3 tt -140.6 136.56 35.72 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 CA-C-O 121.453 0.644 . . . . 0.0 111.323 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.8 m -126.56 131.37 51.56 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.44 178.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -133.59 106.99 11.89 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.815 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.12 125.01 16.99 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.33 2.02 . . . . 0.0 111.829 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.751 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 86.8 m -85.52 -178.04 6.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.549 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -107.12 174.06 19.5 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 111.127 -0.789 . . . . 0.0 111.127 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -107.88 168.49 9.24 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.86 0.33 . . . . 0.0 110.713 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 59.1 tp -83.12 138.76 33.54 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.387 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.1 p -76.71 126.63 31.3 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.296 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 59.1 mttp 61.08 73.53 0.59 Allowed Pre-proline 0 N--CA 1.467 0.384 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.773 -178.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -51.62 -61.29 0.55 Allowed 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.287 2.658 . . . . 0.0 112.562 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 15.5 pttm 41.38 54.7 8.05 Favored Pre-proline 0 CA--C 1.553 1.081 0 C-N-CA 123.999 0.92 . . . . 0.0 113.236 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.49 135.66 70.26 Favored 'Trans proline' 0 C--N 1.366 1.475 0 C-N-CA 122.398 2.065 . . . . 0.0 111.869 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -71.08 -48.18 53.95 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.13 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -165.06 139.09 4.88 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.643 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -140.55 135.7 32.1 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.095 0.474 . . . . 0.0 111.028 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 33.0 t -128.2 106.24 8.9 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.178 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 18.6 pttp -127.36 86.26 2.47 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.376 0.608 . . . . 0.0 110.414 178.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -115.0 136.08 53.52 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.312 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -165.59 155.76 13.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.843 0.354 . . . . 0.0 110.919 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -130.81 89.12 2.71 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.591 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 68.2 mttm 59.24 -168.14 0.15 Allowed 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.45 -178.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -159.08 174.54 14.75 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.525 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 125.48 -122.48 4.6 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.281 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -117.57 147.11 43.12 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.893 0.377 . . . . 0.0 111.044 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -157.33 142.42 16.99 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.38 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 73.21 -43.35 0.56 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.353 0.661 . . . . 0.0 111.316 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -72.41 129.85 39.32 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? 69.52 147.52 0.06 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.572 0.749 . . . . 0.0 110.84 -177.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 88.3 mtp 64.91 19.32 11.82 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.39 0.614 . . . . 0.0 110.709 -177.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 56.1 tp -89.4 127.54 35.83 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.786 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 . . . . . 0 C--N 1.307 -1.276 0 CA-C-O 118.472 -0.775 . . . . 0.0 110.629 -179.125 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.308 -0.317 . . . . 0.0 112.308 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt 55.34 73.29 0.43 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.476 0.655 . . . . 0.0 110.472 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.55 -171.86 2.08 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.672 -177.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 72.86 -58.22 0.61 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.866 0.866 . . . . 0.0 111.92 178.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.9 mttm 64.82 94.52 0.05 OUTLIER Pre-proline 0 N--CA 1.47 0.529 0 O-C-N 123.671 0.607 . . . . 0.0 111.625 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.413 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 10.9 Cg_endo -83.33 -133.33 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.91 2.406 . . . . 0.0 110.882 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.413 ' H ' ' HB2' ' A' ' 6' ' ' PRO . 24.1 mt-10 -88.68 87.14 7.15 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.461 -178.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -176.17 116.35 0.13 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.139 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -93.35 144.21 25.54 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-O 120.771 0.32 . . . . 0.0 111.135 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.6 p -154.17 140.19 11.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-O 121.39 0.614 . . . . 0.0 110.548 178.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.2 pttt -103.24 127.32 50.59 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.224 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.451 ' HB2' ' OE1' ' A' ' 19' ' ' GLN . 60.7 mttp -61.2 -63.84 1.15 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.159 0.504 . . . . 0.0 110.115 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.1 m -153.31 108.46 3.2 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.72 177.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -77.79 136.12 38.07 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.737 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 39.4 m 62.05 70.6 0.57 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 122.033 0.92 . . . . 0.0 110.261 -178.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -156.67 178.87 32.89 Favored Glycine 0 N--CA 1.45 -0.407 0 CA-C-N 114.266 -1.334 . . . . 0.0 113.192 -176.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.461 ' O ' ' HG3' ' A' ' 19' ' ' GLN . 42.0 mm-40 -74.86 169.17 18.46 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.028 0.531 . . . . 0.0 111.737 -178.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.578 ' CD2' ' HB2' ' A' ' 39' ' ' ARG . 94.7 m95 -48.27 119.48 3.0 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.066 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 28.2 mt-30 -108.83 115.73 30.64 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 177.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -105.26 145.12 31.1 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-O 121.686 0.755 . . . . 0.0 112.95 -174.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -93.64 175.23 6.82 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.89 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.3 m -94.2 129.18 44.84 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -176.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.75 96.05 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.396 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -102.03 101.04 16.73 Favored Pre-proline 0 N--CA 1.439 -1.01 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.663 ' O ' ' HB ' ' A' ' 26' ' ' THR . 56.9 Cg_endo -71.98 -20.78 25.12 Favored 'Trans proline' 0 C--O 1.207 -1.07 0 C-N-CA 122.277 1.984 . . . . 0.0 111.068 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.663 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 7.8 m 107.41 -32.47 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.948 1.299 . . . . 0.0 110.155 177.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.9 t 75.51 -162.32 0.06 Allowed 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.482 175.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.97 -93.62 1.05 Allowed Glycine 0 CA--C 1.49 -1.53 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -175.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.463 ' O ' ' HB2' ' A' ' 30' ' ' CYS . 9.8 p-10 -160.13 58.93 0.35 Allowed 'General case' 0 C--N 1.284 -2.271 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 177.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 29' ' ' ASP . 83.3 m 83.14 97.41 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 112.717 -2.038 . . . . 0.0 110.135 -176.071 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -127.3 156.45 20.39 Favored Glycine 0 N--CA 1.434 -1.484 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.826 -178.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.5 tp -80.95 131.39 35.33 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.947 0.374 . . . . 0.0 110.29 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.82 173.93 22.63 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 -176.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 p -143.55 160.14 41.16 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -174.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -137.41 137.15 38.5 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.927 176.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.12 132.44 56.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.722 -0.217 . . . . 0.0 111.145 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -133.02 128.29 5.05 Favored Glycine 0 N--CA 1.445 -0.752 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 176.141 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 66.5 p -130.99 146.9 52.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 117.532 0.666 . . . . 0.0 110.65 -176.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.578 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 6.7 ttp85 -143.83 155.51 44.15 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.489 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 0.7 OUTLIER -149.44 144.0 26.06 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-O 120.781 0.324 . . . . 0.0 110.172 176.928 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.89 -173.48 49.41 Favored Glycine 0 CA--C 1.499 -0.925 0 N-CA-C 110.275 -1.13 . . . . 0.0 110.275 176.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.61 -30.91 69.02 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.342 0.591 . . . . 0.0 109.998 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -89.17 6.33 40.58 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.76 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 10.1 m 46.95 79.63 0.06 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.575 0.702 . . . . 0.0 112.589 -175.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.7 tptt -82.75 2.83 31.95 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.901 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.438 ' H ' HG22 ' A' ' 40' ' ' THR . 93.4 mt-30 48.67 56.27 7.85 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.915 -178.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 m -89.72 102.75 15.44 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.135 0.493 . . . . 0.0 109.937 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 20.5 ptp -136.7 146.29 45.7 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-O 121.078 0.466 . . . . 0.0 111.902 -176.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.424 ' HA ' ' HE3' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -143.04 143.27 31.82 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.484 179.535 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 18.7 m -115.82 138.16 51.41 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.143 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -133.4 146.44 51.22 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.183 0.516 . . . . 0.0 111.518 -175.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -85.0 137.36 33.12 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 176.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.0 t -91.21 154.51 19.25 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 -177.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -112.85 138.87 49.04 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.219 0.533 . . . . 0.0 111.2 -176.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 4.9 tp -118.38 112.79 37.29 Favored Pre-proline 0 C--N 1.319 -0.729 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.888 -178.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.39 106.54 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.668 2.245 . . . . 0.0 112.079 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 79.7 m -95.9 178.23 5.5 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.146 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -70.62 147.33 49.31 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.67 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 63.9 p-90 -62.34 165.75 5.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.069 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -131.52 177.6 7.37 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.604 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -92.51 -2.6 56.11 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.441 0.639 . . . . 0.0 109.437 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -137.02 100.43 4.28 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.459 ' HB3' ' NE2' ' A' ' 100' ' ' GLN . 98.8 m-85 -82.08 47.28 1.1 Allowed 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.17 -174.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.65 179.27 24.43 Favored Glycine 0 N--CA 1.442 -0.911 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.017 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -112.56 -62.95 1.5 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.937 0.398 . . . . 0.0 110.426 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.11 -5.51 25.58 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.535 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.433 ' SG ' HD22 ' A' ' 90' ' ' LEU . 11.8 t -76.78 167.82 21.16 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 176.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.409 ' O ' HD21 ' A' ' 90' ' ' LEU . 56.3 mttp -125.08 125.58 44.01 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.018 -177.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.537 ' HH ' ' HG2' ' A' ' 100' ' ' GLN . 0.1 OUTLIER -124.56 153.56 41.95 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.802 -178.424 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -100.81 140.22 35.4 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.217 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -96.31 139.76 31.98 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.743 0.817 . . . . 0.0 109.008 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.408 HE21 ' HB3' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -77.97 164.76 24.81 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.75 28.97 1.25 Allowed 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -176.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 48.8 t-105 -87.31 -14.03 41.98 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.794 -175.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 108.11 127.07 5.56 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 119.884 -1.151 . . . . 0.0 111.075 -175.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -105.46 134.11 49.12 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-O 120.763 0.315 . . . . 0.0 111.547 -178.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 52.7 t 68.12 104.29 0.05 Allowed 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.809 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.462 ' HB2' ' OG1' ' A' ' 81' ' ' THR . 20.6 m-20 -87.49 112.06 21.81 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 177.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.38 -30.22 68.16 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.795 -175.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -67.83 -29.93 69.21 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.254 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.568 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.5 p -104.45 -8.23 19.27 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.566 -0.453 . . . . 0.0 111.163 -177.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.449 ' O ' HD21 ' A' ' 83' ' ' LEU . . . 59.67 30.39 20.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.512 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 81' ' ' THR . 67.3 mt -129.06 160.37 33.0 Favored 'General case' 0 CA--C 1.498 -1.032 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.204 -175.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.46 ' HB2' ' HB2' ' A' ' 109' ' ' CYS . 35.6 tttp -129.06 140.33 51.65 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.218 -178.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.4 t -137.81 145.32 42.18 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.535 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 mtt180 -140.34 128.99 22.95 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.14 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.2 t -123.82 146.78 48.12 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.928 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -150.08 152.33 24.26 Favored Glycine 0 N--CA 1.437 -1.278 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.16 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.9 m -138.85 148.72 44.06 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.113 0.482 . . . . 0.0 111.976 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.687 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.3 tm? -79.49 126.14 30.47 Favored 'General case' 0 N--CA 1.423 -1.811 0 C-N-CA 123.939 0.895 . . . . 0.0 109.121 178.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -87.53 -33.77 18.84 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.326 -0.55 . . . . 0.0 112.325 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -160.71 141.03 11.36 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -105.22 152.51 22.77 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.935 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.469 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 3.2 mm? -91.02 176.21 6.68 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.889 0.376 . . . . 0.0 110.752 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -73.95 -27.85 61.21 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.888 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -130.45 43.69 3.08 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.697 0.761 . . . . 0.0 109.971 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.469 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -152.11 97.93 2.37 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.142 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -80.32 110.57 15.88 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 71.4 m -110.76 152.8 26.18 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.122 0.487 . . . . 0.0 111.607 -177.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.687 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 4.8 pm0 -68.46 132.71 47.47 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.677 177.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -74.25 -43.2 57.93 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 122.692 0.397 . . . . 0.0 111.333 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.3 t -155.52 146.41 22.35 Favored 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 119.216 -0.994 . . . . 0.0 112.101 175.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.0 m -133.13 138.56 51.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.545 176.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 58.3 m -129.83 127.85 41.11 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 114.726 -1.125 . . . . 0.0 108.993 177.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 19.8 pt -136.69 136.63 48.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-O 120.919 0.39 . . . . 0.0 111.163 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.6 t -126.85 135.36 50.88 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.909 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -135.53 130.98 19.16 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.415 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -52.33 126.53 20.85 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 121.27 1.313 . . . . 0.0 109.946 174.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.46 ' HB2' ' HB2' ' A' ' 84' ' ' LYS . 33.7 t -101.33 -46.18 5.1 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -172.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -62.44 -41.57 99.76 Favored Glycine 0 CA--C 1.509 -0.337 0 C-N-CA 121.085 -0.578 . . . . 0.0 113.095 -175.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.519 ' HZ2' ' HB3' ' A' ' 111' ' ' LYS . 8.0 ttpm? -120.31 135.64 54.95 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-O 120.704 0.287 . . . . 0.0 110.318 -178.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 89.2 mt -76.88 109.76 10.95 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.684 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 7.7 p -91.76 114.1 26.55 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.638 177.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.518 ' HB2' ' HZ2' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -124.91 82.85 60.5 Favored Pre-proline 0 C--N 1.312 -1.054 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.965 -179.117 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -65.29 165.12 23.19 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.373 2.716 . . . . 0.0 113.124 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.426 ' HB2' ' HZ1' ' A' ' 116' ' ' LYS . 4.1 ttmp? -137.43 64.12 44.27 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.726 173.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.01 101.64 0.16 Allowed 'Trans proline' 0 C--N 1.355 0.908 0 C-N-CA 122.402 2.068 . . . . 0.0 112.13 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -76.11 -46.37 29.24 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 56.41 -171.7 0.08 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-N 114.649 -1.159 . . . . 0.0 112.575 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -122.58 167.56 13.25 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.825 177.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 13.5 t -76.88 93.06 3.7 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-O 121.263 0.554 . . . . 0.0 109.671 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -92.08 104.69 17.05 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.02 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.417 ' HE2' ' O ' ' A' ' 125' ' ' LYS . 26.0 pttm -113.49 156.78 22.94 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.597 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -85.48 -33.31 21.88 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.192 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.417 ' O ' ' HE2' ' A' ' 123' ' ' LYS . 87.2 tttt -62.65 136.47 57.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.936 178.428 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -86.16 -177.13 6.19 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 120.866 0.365 . . . . 0.0 110.811 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -85.03 86.24 7.4 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -147.0 101.92 0.24 Allowed Glycine 0 N--CA 1.437 -1.271 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.205 -178.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -145.75 145.66 30.92 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 98.5 mttt 62.91 -169.77 0.18 Allowed 'General case' 0 C--O 1.24 0.562 0 O-C-N 123.62 0.575 . . . . 0.0 109.949 -175.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 56.73 68.79 0.81 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.192 0.52 . . . . 0.0 111.414 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -112.04 129.48 56.19 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.161 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.0 mttt 61.12 82.83 0.16 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.412 0.625 . . . . 0.0 111.287 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 84.5 mtp -83.06 131.02 35.18 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.856 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 92.1 mt 62.24 25.85 15.47 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.17 0.588 . . . . 0.0 111.142 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 C--O 1.245 0.862 0 CA-C-O 118.495 -0.764 . . . . 0.0 110.628 179.689 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.039 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -92.91 166.27 12.48 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 117.085 0.443 . . . . 0.0 112.141 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.6 m95 -50.32 122.14 6.55 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.654 176.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -111.82 124.29 52.05 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.429 ' CE3' ' HA3' ' A' ' 37' ' ' GLY . 98.2 m95 -104.46 136.8 43.34 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.39 0.614 . . . . 0.0 112.169 -175.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.0 m -95.42 172.07 8.31 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.192 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.0 m -90.39 130.97 38.77 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 CA-C-O 121.756 0.788 . . . . 0.0 111.034 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 43.4 t -61.18 134.46 57.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.35 -1.295 . . . . 0.0 112.168 -176.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.9 t -96.8 107.93 39.99 Favored Pre-proline 0 N--CA 1.438 -1.045 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.56 ' O ' ' HB ' ' A' ' 26' ' ' THR . 18.1 Cg_endo -59.55 -19.03 50.3 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.935 2.423 . . . . 0.0 112.713 -176.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.56 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 30.7 m 85.98 -66.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.029 177.331 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.2 t 68.23 121.69 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.463 0.649 . . . . 0.0 111.081 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 161.05 66.53 0.02 OUTLIER Glycine 0 CA--C 1.494 -1.257 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.407 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 62.07 40.3 12.18 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 39.1 m 76.91 88.91 0.08 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.126 -178.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.63 149.43 16.87 Favored Glycine 0 CA--C 1.503 -0.665 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.4 tp -78.94 116.43 19.25 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.054 0.454 . . . . 0.0 112.089 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.31 162.32 34.9 Favored Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.085 178.294 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 p -136.13 154.53 50.95 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.465 0.65 . . . . 0.0 112.402 -177.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -125.21 138.44 54.12 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -118.77 129.08 55.05 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.905 0.383 . . . . 0.0 110.999 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.429 ' HA3' ' CE3' ' A' ' 20' ' ' TRP . . . -124.55 143.5 14.72 Favored Glycine 0 N--CA 1.437 -1.238 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 177.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.621 HG22 ' HB3' ' A' ' 48' ' ' MET . 50.7 p -133.3 158.41 43.02 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 117.637 0.719 . . . . 0.0 110.727 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.517 ' HG2' ' N ' ' A' ' 40' ' ' THR . 71.7 ttt180 -154.73 161.1 41.66 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.64 ' HA ' ' O ' ' A' ' 45' ' ' LYS . 1.3 p -106.58 145.79 31.47 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 174.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.89 -176.99 31.57 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.099 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.39 -25.77 63.4 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.567 0.699 . . . . 0.0 110.441 -177.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -98.16 16.36 21.53 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.91 178.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 73.4 m 61.23 79.74 0.24 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.323 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.64 ' O ' ' HA ' ' A' ' 40' ' ' THR . 75.8 mmtt -130.36 146.03 51.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 177.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -74.75 108.46 7.51 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.03 0.443 . . . . 0.0 110.873 -177.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -115.8 136.59 52.91 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.621 ' HB3' HG22 ' A' ' 38' ' ' THR . 16.3 ptm -144.96 154.34 42.47 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -147.71 142.59 26.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.642 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.1 m -116.86 138.81 51.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 120.848 0.356 . . . . 0.0 110.476 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -120.48 152.66 37.71 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -104.78 127.35 52.55 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 57.6 m -90.69 -165.39 1.34 Allowed 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -175.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -117.55 140.06 50.12 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 120.772 0.32 . . . . 0.0 110.921 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 6.9 tp -109.77 120.22 45.53 Favored Pre-proline 0 C--N 1.305 -1.353 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.709 -178.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -62.51 103.44 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.368 2.045 . . . . 0.0 111.37 177.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.313 -0.996 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.572 -179.657 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.094 0 CA-C-O 120.896 0.165 . . . . 0.0 112.797 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -156.2 -79.87 0.08 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -89.6 -20.72 23.39 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.403 ' HA ' HD13 ' A' ' 94' ' ' LEU . 45.0 t -76.24 178.74 6.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.425 176.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -132.76 125.82 31.02 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.53 -178.096 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.438 ' HE1' ' O ' ' A' ' 100' ' ' GLN . 1.6 t80 -141.23 141.36 34.02 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.766 -177.313 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -123.7 134.02 53.79 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 110.498 -0.186 . . . . 0.0 110.498 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -97.09 131.64 43.67 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 176.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.485 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 3.6 pt20 -115.66 161.75 18.23 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -135.97 106.04 6.31 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 121.141 0.496 . . . . 0.0 111.288 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 59.3 t90 -79.06 -21.7 46.41 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.211 176.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -159.59 158.46 29.64 Favored Glycine 0 N--CA 1.434 -1.492 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.191 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -94.33 146.63 23.91 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 2.1 t -21.33 126.58 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.225 0 O-C-N 124.563 1.164 . . . . 0.0 112.58 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -98.29 109.16 21.96 Favored 'General case' 0 CA--C 1.494 -1.207 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 mt -75.51 -21.21 58.19 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -177.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -67.17 -36.48 81.89 Favored 'General case' 0 CA--C 1.486 -1.496 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -174.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 74.1 p -104.87 -7.28 19.48 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.875 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.425 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 61.95 37.31 15.15 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.348 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.458 ' HA ' ' H ' ' A' ' 109' ' ' CYS . 66.3 mt -128.1 152.31 48.14 Favored 'General case' 0 CA--C 1.498 -1.057 0 CA-C-O 121.276 0.56 . . . . 0.0 111.873 -176.067 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 109' ' ' CYS . 87.0 tttt -135.65 136.48 41.0 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.725 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.1 t -134.52 144.49 48.05 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 120.904 0.383 . . . . 0.0 111.551 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -142.54 142.87 32.28 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.925 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.485 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 5.0 m -112.61 147.21 37.16 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.651 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -133.82 156.49 22.34 Favored Glycine 0 C--N 1.318 -0.467 0 C-N-CA 121.14 -0.552 . . . . 0.0 111.937 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.7 p -146.31 141.7 27.55 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-N 116.955 0.378 . . . . 0.0 111.941 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.622 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 5.3 tt -68.78 127.47 33.18 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.331 176.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -97.57 -31.47 12.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.613 178.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -156.77 140.07 15.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.617 0.246 . . . . 0.0 110.876 178.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.414 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -113.94 131.51 56.29 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.518 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 8.7 mp -93.19 175.94 6.59 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -178.03 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -76.7 -27.94 55.68 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.692 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -126.49 14.09 7.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.028 0.918 . . . . 0.0 110.698 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.518 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -143.23 91.2 2.25 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.111 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -103.61 152.63 21.53 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.721 -176.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' CYS . . . . . 0.445 ' HB2' HD12 ' A' ' 90' ' ' LEU . 67.8 m -134.91 156.19 49.4 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 121.295 0.569 . . . . 0.0 111.855 -177.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.622 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 19.5 pm0 -64.02 149.91 46.43 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.801 -1.091 . . . . 0.0 108.449 169.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.509 ' HA ' ' HB3' ' A' ' 90' ' ' LEU . 57.3 pttt -81.52 -31.69 32.68 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -173.557 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.0 t -155.69 148.82 24.55 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 119.387 -0.925 . . . . 0.0 112.451 177.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 26.8 m -134.27 143.02 39.3 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.15 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.275 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 12.2 t -128.18 128.95 45.72 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-N 114.482 -1.236 . . . . 0.0 107.912 175.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.9 tt -141.07 139.69 33.23 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 CA-C-O 121.221 0.534 . . . . 0.0 111.375 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 16.3 m -130.41 127.48 39.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -133.52 132.53 21.91 Favored Pre-proline 0 C--N 1.305 -1.365 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.447 ' HA ' HD23 ' A' ' 83' ' ' LEU . 50.8 Cg_exo -51.21 118.07 3.98 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 121.561 1.507 . . . . 0.0 110.956 178.111 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.458 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 9.4 t -77.52 -30.06 52.71 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.239 -176.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.279 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 178.026 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.38 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -109.46 166.17 11.09 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.518 0.675 . . . . 0.0 111.243 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.422 ' HA ' ' O ' ' A' ' 38' ' ' THR . 98.6 m95 -65.08 128.98 38.05 Favored 'General case' 0 N--CA 1.418 -2.067 0 CA-C-N 114.462 -1.245 . . . . 0.0 111.413 174.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -87.66 137.96 31.88 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 176.154 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -110.27 124.02 50.87 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 121.324 0.583 . . . . 0.0 112.329 -174.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.0 m -107.13 168.51 9.16 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.21 -0.905 . . . . 0.0 108.961 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.6 m -96.51 152.9 3.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.569 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 79.3 m -66.91 129.85 41.24 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.788 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 17.1 m -109.29 111.1 60.14 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.799 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.06 156.83 63.96 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.404 2.07 . . . . 0.0 111.686 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.6 m -91.25 -25.81 19.31 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-O 121.247 0.546 . . . . 0.0 109.549 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -160.56 136.75 8.54 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.644 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -69.94 -26.96 73.69 Favored Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -80.99 54.24 2.16 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.4 m 59.41 88.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.114 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.519 ' H ' HD13 ' A' ' 55' ' ' ILE . . . -144.34 141.82 10.48 Favored Glycine 0 N--CA 1.437 -1.252 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.531 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.7 tp -57.04 152.15 13.73 Favored 'General case' 0 C--O 1.203 -1.392 0 C-N-CA 122.502 0.321 . . . . 0.0 111.38 -177.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.0 171.77 22.31 Favored Glycine 0 N--CA 1.438 -1.23 0 N-CA-C 110.57 -1.012 . . . . 0.0 110.57 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.4 p -135.68 154.18 51.37 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 117.441 0.62 . . . . 0.0 112.06 -178.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -137.09 142.2 42.35 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 175.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -130.25 130.87 45.14 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 120.757 0.313 . . . . 0.0 111.627 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.54 145.81 17.52 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.422 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 71.2 p -134.91 154.76 51.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 117.843 0.821 . . . . 0.0 111.115 -177.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -118.11 154.51 31.99 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.2 m -150.73 161.87 41.8 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.387 -175.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 166.16 -173.44 41.68 Favored Glycine 0 N--CA 1.434 -1.47 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.54 -32.72 64.36 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 117.593 0.696 . . . . 0.0 111.411 -178.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -105.52 0.97 27.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.961 0.41 . . . . 0.0 111.843 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 78.2 m -98.71 117.32 32.91 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 120.91 0.386 . . . . 0.0 111.858 -177.38 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.77 140.56 40.68 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.793 175.31 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 62.53 19.79 11.49 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.671 0.607 . . . . 0.0 111.466 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -84.11 77.89 9.86 Favored 'General case' 0 N--CA 1.437 -1.105 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 177.651 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 55.2 mtt -134.31 152.86 52.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.057 -175.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -148.54 131.45 16.15 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.374 178.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.2 m -117.1 138.02 51.91 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -131.62 152.24 50.98 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 120.729 0.299 . . . . 0.0 110.824 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -85.95 129.44 34.83 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 176.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 9.1 t -95.78 178.83 5.32 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -175.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -113.65 141.14 47.58 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.438 0.637 . . . . 0.0 111.284 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.519 HD13 ' H ' ' A' ' 31' ' ' GLY . 12.4 tt -123.59 120.29 26.93 Favored Pre-proline 0 C--N 1.299 -1.605 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.64 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 55' ' ' ILE . 12.4 Cg_exo -70.41 98.44 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.375 2.05 . . . . 0.0 111.822 178.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 54.1 t . . . . . 0 C--N 1.313 -0.983 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.924 178.807 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.923 0 N-CA-C 111.626 -0.589 . . . . 0.0 111.626 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.06 -75.99 0.59 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.622 0.248 . . . . 0.0 110.701 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -93.68 -21.58 19.27 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.161 0.505 . . . . 0.0 110.588 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 56.3 m -83.42 160.52 21.56 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.378 178.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -130.81 127.82 39.43 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.858 ' CE2' ' HB2' ' A' ' 90' ' ' LEU . 54.8 m-85 -109.27 128.47 55.1 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.611 -178.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -100.51 117.58 34.94 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 177.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.565 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 44.2 p90 -99.02 145.11 27.41 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-O 120.83 0.347 . . . . 0.0 111.158 -176.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -89.78 162.34 15.57 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 71.74 116.85 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.16 0.912 . . . . 0.0 110.661 -175.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -89.11 -3.12 58.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.757 0.789 . . . . 0.0 109.826 -177.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.92 140.13 11.54 Favored Glycine 0 N--CA 1.436 -1.336 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.943 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -107.98 141.23 39.95 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.626 ' HA ' ' HB3' ' A' ' 84' ' ' LYS . 48.9 t 79.53 102.24 0.07 Allowed 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 121.662 0.744 . . . . 0.0 110.777 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -83.73 111.85 19.54 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 114.874 -1.057 . . . . 0.0 108.51 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.552 ' H ' HD23 ' A' ' 79' ' ' LEU . 2.5 pt? -63.82 -31.81 73.12 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.612 -1.176 . . . . 0.0 113.254 -173.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -74.95 -28.7 60.69 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.438 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.626 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.7 p -105.19 -8.55 18.29 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 120.004 -0.678 . . . . 0.0 112.44 -175.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.32 25.08 12.33 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 123.466 0.706 . . . . 0.0 110.625 -175.162 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 81' ' ' THR . 44.9 mt -128.71 149.49 50.67 Favored 'General case' 0 C--O 1.202 -1.437 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.121 -177.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.626 ' HB3' ' HA ' ' A' ' 77' ' ' CYS . 8.3 ptmt -121.58 135.46 55.0 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 120.879 0.371 . . . . 0.0 110.246 177.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.3 m -137.95 138.3 38.82 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -177.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -140.33 136.42 33.19 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 120.814 0.34 . . . . 0.0 110.179 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.5 m -128.75 134.23 48.36 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.63 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.565 ' HA2' ' HA ' ' A' ' 71' ' ' PHE . . . -135.69 152.3 20.92 Favored Glycine 0 CA--C 1.495 -1.214 0 C-N-CA 120.466 -0.874 . . . . 0.0 111.784 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 20.1 p -141.04 146.42 37.18 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.24 0.543 . . . . 0.0 111.961 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.858 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.8 tm? -91.29 121.46 33.05 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.236 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -97.4 -12.39 22.81 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -174.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 92' ' ' ARG . 14.9 ttm180 -161.57 133.76 5.8 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.564 0.221 . . . . 0.0 110.496 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -113.6 148.6 35.91 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.448 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 9.8 mp -85.74 172.09 11.09 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 -178.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -78.46 -18.38 54.95 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.112 0.482 . . . . 0.0 110.404 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -119.63 37.6 4.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.698 0.761 . . . . 0.0 109.706 179.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.448 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -157.63 124.26 4.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.335 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -111.1 122.98 49.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.648 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' CYS . . . . . 0.455 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 74.7 m -145.68 148.3 32.9 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.956 -0.566 . . . . 0.0 112.177 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.74 152.54 45.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.267 178.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -73.52 -35.72 65.62 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.915 -175.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 9.3 t -156.26 148.91 23.8 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 118.877 -1.129 . . . . 0.0 113.449 179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.1 m -131.63 139.26 51.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 113.8 -1.546 . . . . 0.0 110.83 175.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 56.7 m -129.74 133.78 47.22 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.411 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.48 132.08 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 4.8 m -131.82 126.28 33.94 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -135.5 138.17 27.89 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -62.71 123.15 11.81 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 121.7 1.6 . . . . 0.0 110.252 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.417 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 13.4 t -83.16 178.37 8.14 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.763 0.316 . . . . 0.0 110.479 -176.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.759 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -177.942 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.799 0 N-CA-C 112.193 -0.363 . . . . 0.0 112.193 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 19' ' ' GLN . 42.3 mt-10 -75.83 171.3 14.62 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 122.46 0.304 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.677 ' HA ' ' O ' ' A' ' 38' ' ' THR . 88.5 m95 -45.92 119.51 2.27 Favored 'General case' 0 N--CA 1.442 -0.839 0 O-C-N 123.894 0.746 . . . . 0.0 112.698 -177.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.47 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 68.3 mt-30 -113.15 115.56 28.46 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -100.45 138.69 37.17 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.225 0.536 . . . . 0.0 111.481 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.0 t -101.33 172.44 6.99 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.416 -0.811 . . . . 0.0 108.895 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 29.1 m -91.95 148.56 4.56 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 62.3 m -63.6 128.41 35.7 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.829 -175.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 p -106.23 114.79 61.99 Favored Pre-proline 0 N--CA 1.44 -0.93 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -61.29 148.09 93.83 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.599 2.2 . . . . 0.0 112.972 -176.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.3 m -87.64 -28.53 21.81 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-O 121.678 0.752 . . . . 0.0 109.195 178.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 46.3 t -149.95 134.58 17.56 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.888 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.07 -30.57 69.78 Favored Glycine 0 CA--C 1.504 -0.616 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.338 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -68.17 -41.47 81.44 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.3 m 166.02 92.15 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.583 1.153 . . . . 0.0 110.847 178.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -141.31 120.09 1.62 Allowed Glycine 0 CA--C 1.498 -0.976 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.895 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.452 ' H ' HD22 ' A' ' 32' ' ' LEU . 3.2 mm? -53.68 114.13 1.43 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.998 0.428 . . . . 0.0 111.671 -176.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.96 175.77 53.96 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.886 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 p -136.42 154.66 50.73 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -133.71 146.04 50.44 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.001 176.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -120.82 131.56 54.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.514 0.197 . . . . 0.0 110.649 -178.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.47 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -128.21 151.37 18.76 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 178.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.677 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 58.8 p -130.0 149.37 51.75 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 117.395 0.598 . . . . 0.0 111.25 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.502 ' HB2' ' CE2' ' A' ' 18' ' ' TRP . 53.2 ttp180 -132.24 161.4 33.53 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.496 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 9.0 t -113.75 162.7 15.97 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-O 121.756 0.788 . . . . 0.0 111.087 178.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -111.82 -174.29 19.67 Favored Glycine 0 C--N 1.294 -1.788 0 CA-C-N 114.042 -1.435 . . . . 0.0 110.058 177.137 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.94 -30.51 69.83 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 117.562 0.681 . . . . 0.0 110.099 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -101.93 5.44 40.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.412 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.429 ' HA ' ' OG1' ' A' ' 40' ' ' THR . 52.9 t 60.51 70.85 0.6 Allowed 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.991 -175.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -90.89 -18.41 24.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.055 -178.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 39' ' ' ARG . 15.3 mm100 66.74 100.56 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.893 0.854 . . . . 0.0 112.829 178.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 m -101.72 143.32 31.8 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 114.74 -1.118 . . . . 0.0 108.542 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -120.85 152.59 38.21 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.18 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -141.89 136.07 30.12 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.9 m -129.77 136.72 49.96 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -133.64 151.1 51.6 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-O 121.053 0.454 . . . . 0.0 111.294 -176.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.463 ' HD2' ' N ' ' A' ' 52' ' ' ARG . 0.2 OUTLIER -101.91 128.1 48.45 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.44 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 31.7 m -92.65 170.58 9.61 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 -174.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.7 mttm -113.79 139.91 48.74 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.371 0.605 . . . . 0.0 112.125 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.9 mt -112.37 131.54 22.55 Favored Pre-proline 0 C--N 1.305 -1.369 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.631 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.449 ' O ' ' HB2' ' A' ' 57' ' ' CYS . 9.5 Cg_endo -52.45 -54.5 5.08 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.426 2.75 . . . . 0.0 113.486 -178.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 56' ' ' PRO . 41.9 m . . . . . 0 N--CA 1.472 0.672 0 C-N-CA 123.085 0.554 . . . . 0.0 112.357 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.949 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -132.66 1.19 3.66 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -82.92 -20.93 34.41 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.245 0.545 . . . . 0.0 110.455 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.404 ' HB2' HD21 ' A' ' 90' ' ' LEU . 6.5 p -99.67 -176.48 3.28 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 175.125 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -129.85 142.44 50.67 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.491 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.429 ' CE2' HD23 ' A' ' 90' ' ' LEU . 29.6 m-85 -117.44 152.49 34.89 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.01 -178.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -124.96 118.77 26.98 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.406 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 28.3 p90 -95.79 135.57 37.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.201 0.524 . . . . 0.0 111.135 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.482 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 0.2 OUTLIER -110.5 162.17 14.96 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.808 -178.577 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -124.55 87.27 2.69 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.152 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 47.9 t-105 -87.24 -24.35 24.42 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.417 0.627 . . . . 0.0 109.526 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -161.62 118.19 0.81 Allowed Glycine 0 N--CA 1.439 -1.154 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.764 178.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -96.85 116.23 28.8 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.491 ' SG ' ' HG3' ' A' ' 84' ' ' LYS . 55.7 m 59.99 102.06 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.917 0.76 . . . . 0.0 112.022 -176.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -69.81 111.94 5.9 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 177.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 20.2 mt -69.29 -28.93 66.71 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.695 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -65.27 -38.59 90.77 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.219 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 65.7 p -106.72 -14.59 14.97 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.278 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 69.48 39.89 1.53 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.921 -1.036 . . . . 0.0 108.727 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.464 ' HA ' ' H ' ' A' ' 109' ' ' CYS . 90.3 mt -125.34 168.01 14.13 Favored 'General case' 0 C--O 1.204 -1.321 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.859 -178.034 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.491 ' HG3' ' SG ' ' A' ' 77' ' ' CYS . 36.1 tttm -121.15 137.44 54.67 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -177.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 14.2 t -137.12 146.7 45.37 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.495 0.664 . . . . 0.0 110.878 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -137.56 135.54 36.77 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.39 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.482 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 33.4 m -107.44 141.97 38.0 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.406 ' HA2' ' HA ' ' A' ' 71' ' ' PHE . . . -136.47 152.57 21.25 Favored Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 178.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.494 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 19.0 m -141.08 147.94 39.37 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.063 0.459 . . . . 0.0 111.28 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.587 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.1 tm? -72.73 119.03 16.4 Favored 'General case' 0 N--CA 1.408 -2.571 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.388 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -105.39 -25.69 12.27 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 120.429 -0.509 . . . . 0.0 111.114 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -155.85 133.61 11.15 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.042 0.448 . . . . 0.0 111.004 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -135.47 150.72 49.89 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.788 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.4 mp -84.49 158.99 20.82 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 177.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -68.29 -27.08 66.0 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.757 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -100.37 38.85 1.43 Allowed 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.509 0.671 . . . . 0.0 109.304 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.83 99.26 1.39 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.626 -177.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -84.23 133.19 34.59 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.974 179.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 74.8 m -145.94 140.71 27.13 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.811 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.587 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 1.5 pm0 -67.54 153.87 42.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.707 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.61 ' HD3' ' H ' ' A' ' 101' ' ' LYS . 0.3 OUTLIER -73.93 -26.52 60.56 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.316 -174.671 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.494 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 8.8 t -149.22 149.82 31.59 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-O 122.016 0.912 . . . . 0.0 113.043 179.089 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 29.6 m -129.17 144.04 39.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 113.857 -1.52 . . . . 0.0 110.749 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 34.6 m -129.51 131.8 46.72 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.839 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.09 136.39 47.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.807 0.337 . . . . 0.0 110.358 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.3 p -123.18 137.0 55.0 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.549 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -134.46 128.78 19.32 Favored Pre-proline 0 C--O 1.21 -1.019 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.553 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -50.29 126.21 16.95 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 122.129 1.886 . . . . 0.0 112.394 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.464 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 43.1 t -97.71 107.13 19.56 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.569 -177.023 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.928 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.072 179.56 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.487 ' O ' ' HD2' ' A' ' 39' ' ' ARG . . . . . . . . 0 N--CA 1.438 -1.2 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -102.91 164.62 11.51 Favored 'General case' 0 CA--C 1.494 -1.198 0 CA-C-N 117.341 0.57 . . . . 0.0 110.552 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.576 ' HA ' ' O ' ' A' ' 38' ' ' THR . 74.6 m95 -52.57 118.14 3.4 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.2 mm-40 -119.33 112.74 19.81 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 172.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -97.35 145.08 26.48 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.042 -177.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.8 m -93.77 171.68 8.72 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.955 -1.02 . . . . 0.0 108.583 177.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.3 m -93.53 155.71 3.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.253 -176.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 38.0 t -69.03 99.98 1.16 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 -176.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.2 p -94.48 132.96 27.75 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.652 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.0 110.94 0.75 Allowed 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.641 2.227 . . . . 0.0 111.728 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 97.0 m -65.95 -23.14 66.54 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.146 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.449 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 12.2 t -133.14 176.56 8.4 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.927 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.47 80.26 0.01 OUTLIER Glycine 0 C--N 1.334 0.454 0 O-C-N 124.006 0.816 . . . . 0.0 113.658 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.9 t70 76.67 -38.99 0.33 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.506 1.122 . . . . 0.0 111.939 175.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 47.4 t -123.66 109.61 13.94 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.934 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.449 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -172.94 154.99 22.0 Favored Glycine 0 CA--C 1.491 -1.42 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 -178.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.5 tp -64.13 108.99 1.69 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 118.224 1.012 . . . . 0.0 109.01 178.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.26 175.31 25.12 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.113 -0.948 . . . . 0.0 114.825 -173.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.84 153.66 50.72 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.694 -0.753 . . . . 0.0 111.395 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -144.15 138.35 28.09 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -115.57 132.01 56.76 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.797 -0.183 . . . . 0.0 111.333 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -131.24 136.22 8.69 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 177.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.576 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 6.9 p -123.89 148.24 46.99 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 121.194 -0.202 . . . . 0.0 111.076 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.556 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 11.2 tpt85 -157.01 160.1 38.67 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.334 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.58 146.17 26.38 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.513 175.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -98.72 -150.35 25.78 Favored Glycine 0 C--O 1.217 -0.967 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.84 -36.56 49.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 118.085 0.942 . . . . 0.0 109.681 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 20.6 mm-40 -85.47 -0.52 55.15 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.216 174.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 5.2 m 40.05 60.57 1.7 Allowed 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.749 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 36.2 mmtm -118.28 141.8 48.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.028 0.442 . . . . 0.0 112.038 -178.089 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.445 ' O ' ' HG3' ' A' ' 48' ' ' MET . 47.9 mt-30 45.22 -108.34 0.15 Allowed 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.082 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.441 ' O ' ' HB3' ' A' ' 39' ' ' ARG . 0.8 OUTLIER 48.32 27.74 1.43 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 178.693 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.445 ' HG3' ' O ' ' A' ' 46' ' ' GLN . 86.9 mtp -113.96 146.12 40.57 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -147.6 137.37 22.76 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.469 0.652 . . . . 0.0 111.78 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.1 p -114.4 138.46 50.54 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 174.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -134.1 151.53 51.42 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-O 121.875 0.845 . . . . 0.0 112.098 -174.271 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -85.67 139.05 31.7 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 113.677 -1.601 . . . . 0.0 109.144 172.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 52.9 t -117.98 159.24 23.5 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -173.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.5 tttm -114.27 124.88 53.11 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 52.9 mt -101.94 128.47 28.61 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.413 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.78 48.66 2.25 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 123.131 2.554 . . . . 0.0 113.107 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 26.8 p . . . . . 0 C--N 1.317 -0.833 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.712 179.062 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.667 0 N-CA-C 111.992 -0.443 . . . . 0.0 111.992 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.62 -62.87 1.43 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.878 0.37 . . . . 0.0 110.731 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -86.28 -5.15 59.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.131 0.491 . . . . 0.0 110.505 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 62.8 m -65.73 141.01 58.49 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.686 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -116.8 125.39 51.53 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.467 ' HE2' ' HB2' ' A' ' 90' ' ' LEU . 36.5 m-85 -126.41 146.85 49.91 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -173.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.44 ' HB2' ' HE3' ' A' ' 91' ' ' LYS . 64.2 tt0 -126.49 115.73 20.01 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 106.189 -1.782 . . . . 0.0 106.189 170.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -101.29 156.42 17.46 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -173.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 35.3 tt0 -78.66 144.76 35.07 Favored 'General case' 0 N--CA 1.4 -2.971 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 172.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' A' ' 72' ' ' GLN . . . 166.5 120.91 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.288 0.367 . . . . 0.0 110.45 -173.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' TRP . . . . . 0.513 ' CZ3' ' HB2' ' A' ' 76' ' ' GLU . 1.1 p-90 -92.16 -8.66 44.95 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.239 0.542 . . . . 0.0 110.379 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 107.87 -39.32 2.94 Favored Glycine 0 CA--C 1.507 -0.437 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.04 175.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.513 ' HB2' ' CZ3' ' A' ' 74' ' ' TRP . 36.9 mt-10 -95.65 142.6 27.77 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 114.978 -0.611 . . . . 0.0 110.34 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 31.0 p -78.31 171.14 15.51 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 176.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -94.06 121.53 35.64 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.491 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 20.8 mt -72.83 -30.15 63.8 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.14 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -67.45 -33.36 74.98 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 121.321 0.581 . . . . 0.0 110.125 -177.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.723 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 76.8 p -104.27 -9.25 18.72 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.643 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.19 24.64 11.62 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.126 0.97 . . . . 0.0 111.475 -177.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.723 ' HG ' ' O ' ' A' ' 81' ' ' THR . 65.6 mt -131.39 165.08 24.28 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-O 120.961 0.41 . . . . 0.0 110.41 -172.156 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -119.83 132.71 55.66 Favored 'General case' 0 N--CA 1.414 -2.253 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.2 p -135.14 142.0 46.09 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.027 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.6 mtm180 -139.94 128.49 22.93 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.2 m -99.95 145.34 27.96 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -145.31 149.37 21.49 Favored Glycine 0 N--CA 1.434 -1.478 0 C-N-CA 118.879 -1.629 . . . . 0.0 112.664 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 101' ' ' LYS . 29.1 m -132.12 149.34 52.43 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.103 -0.549 . . . . 0.0 111.015 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.595 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.1 tm? -75.48 122.04 23.25 Favored 'General case' 0 N--CA 1.414 -2.268 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.44 ' HE3' ' HB2' ' A' ' 70' ' ' GLN . 11.4 ptpt -101.26 -15.23 17.36 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -177.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -162.55 130.82 3.97 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.439 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -138.22 144.19 40.5 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.4 mp -91.28 170.54 9.9 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.442 178.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -69.54 -13.42 62.33 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.278 0.561 . . . . 0.0 110.996 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -107.15 29.92 6.67 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.16 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.55 115.95 3.79 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.445 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -87.69 123.46 32.55 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 80.4 m -134.83 139.76 45.32 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.541 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.595 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 1.2 pm0 -70.03 145.18 51.93 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.193 176.495 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 89' ' ' SER . 36.4 ttpt -72.25 -42.47 65.62 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.225 -176.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.2 t -152.44 148.19 27.15 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 118.512 -1.275 . . . . 0.0 113.019 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.3 m -131.88 149.35 32.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.88 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 11.3 t -114.08 139.61 49.16 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 114.238 -1.346 . . . . 0.0 109.12 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 13.3 mt -131.03 138.31 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.118 0 CA-C-O 120.917 0.389 . . . . 0.0 111.015 -173.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.7 t -130.09 128.9 42.8 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.03 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -136.09 129.32 17.95 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.294 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.84 113.65 3.07 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 121.086 1.19 . . . . 0.0 110.61 175.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 50.7 t -81.3 67.41 7.23 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -175.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.425 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.708 177.72 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.061 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 17' ' ' GLU . 1.8 pm0 -86.91 166.92 14.76 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -50.63 122.04 6.65 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.988 -1.006 . . . . 0.0 112.389 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -103.51 136.73 42.7 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 176.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -120.83 130.89 54.15 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.634 0.73 . . . . 0.0 112.425 -175.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.2 t -94.49 171.82 8.57 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 114.502 -1.226 . . . . 0.0 107.845 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.8 m -92.36 142.67 12.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.042 -178.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.8 t -66.36 132.43 48.32 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.362 -176.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.4 t -93.11 116.35 66.36 Favored Pre-proline 0 C--N 1.311 -1.102 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.513 ' O ' ' HB ' ' A' ' 26' ' ' THR . 19.2 Cg_endo -57.62 -23.96 59.89 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.169 2.579 . . . . 0.0 113.138 -175.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.513 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 55.5 m 83.01 -41.92 0.1 Allowed 'General case' 0 C--O 1.234 0.238 0 C-N-CA 123.209 0.604 . . . . 0.0 111.091 177.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 t 70.41 -146.56 0.08 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.736 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.403 ' O ' ' HB3' ' A' ' 29' ' ' ASP . . . 64.46 51.5 51.73 Favored Glycine 0 CA--C 1.498 -1.029 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -176.064 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.403 ' HB3' ' O ' ' A' ' 28' ' ' GLY . 20.8 t70 72.92 -57.72 0.62 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.624 0.77 . . . . 0.0 111.146 -178.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 68.1 m -155.21 96.95 1.87 Allowed 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 123.597 0.759 . . . . 0.0 109.043 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.408 ' H ' HD13 ' A' ' 55' ' ' ILE . . . -120.84 145.85 17.39 Favored Glycine 0 N--CA 1.431 -1.682 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.887 -179.109 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.7 tp -72.39 109.45 6.1 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.71 155.08 52.76 Favored Glycine 0 N--CA 1.438 -1.181 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.14 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.0 p -135.43 152.27 51.22 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.228 0.537 . . . . 0.0 111.306 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -133.49 149.31 51.73 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -130.37 131.11 45.16 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 120.723 0.297 . . . . 0.0 110.917 -178.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -123.07 144.72 15.86 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 109.771 -1.331 . . . . 0.0 109.771 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 28.2 p -134.91 153.94 51.87 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 117.429 0.615 . . . . 0.0 111.65 -177.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.444 ' HG2' ' N ' ' A' ' 40' ' ' THR . 22.6 ttt180 -149.53 161.35 42.3 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.275 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.511 ' HB ' ' HA ' ' A' ' 44' ' ' CYS . 1.3 p -104.95 154.42 20.12 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 177.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -87.35 -166.53 42.61 Favored Glycine 0 CA--C 1.507 -0.423 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.79 -23.33 58.49 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 118.46 1.13 . . . . 0.0 108.911 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.428 ' HG3' ' HG2' ' A' ' 45' ' ' LYS . 6.7 pt-20 -94.86 7.79 44.81 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.495 -1.23 . . . . 0.0 109.587 176.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.511 ' HA ' ' HB ' ' A' ' 40' ' ' THR . 93.7 m 65.08 30.32 11.67 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.996 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 40' ' ' THR . 32.8 mmtp -80.05 -178.34 6.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.668 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -96.2 109.21 21.71 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.976 0.417 . . . . 0.0 111.904 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -109.43 126.38 53.41 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 175.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 27.3 ttt -137.02 153.25 50.69 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -173.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -144.8 135.15 24.27 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.242 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.5 m -116.98 139.04 51.14 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -134.72 152.13 51.52 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.797 0.332 . . . . 0.0 110.6 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.444 ' N ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -105.41 130.91 53.4 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.156 179.249 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 58.1 m -87.91 -168.52 2.24 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 39.3 tttp -124.51 131.47 53.49 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.408 HD13 ' H ' ' A' ' 31' ' ' GLY . 20.1 tt -106.45 118.14 55.36 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 121.014 0.435 . . . . 0.0 110.544 -179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.28 -29.12 3.27 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.579 2.186 . . . . 0.0 112.91 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 62.1 m . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 122.849 0.459 . . . . 0.0 112.05 179.651 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.786 0 N-CA-C 112.153 -0.379 . . . . 0.0 112.153 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -129.65 -62.03 0.98 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.056 0.455 . . . . 0.0 110.382 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -83.69 -15.14 49.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.589 0.709 . . . . 0.0 109.525 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 9.9 p -153.81 -166.14 2.31 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 114.981 -1.009 . . . . 0.0 108.469 -177.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -132.01 147.36 52.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.481 ' CE2' HD23 ' A' ' 90' ' ' LEU . 48.5 m-85 -118.35 151.55 37.52 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-O 121.18 0.514 . . . . 0.0 111.899 -177.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.462 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 48.8 tp60 -114.76 117.66 31.39 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.033 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -96.58 141.55 29.71 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -119.03 162.39 18.64 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.099 0.476 . . . . 0.0 109.851 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.3 156.76 44.4 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.156 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -103.99 -11.53 17.36 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 165.12 -147.45 12.53 Favored Glycine 0 N--CA 1.428 -1.839 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -117.52 113.87 22.62 Favored 'General case' 0 N--CA 1.427 -1.589 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.869 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 14.9 t 60.77 118.25 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 O-C-N 124.049 0.843 . . . . 0.0 111.633 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -68.82 109.97 4.13 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.9 mt -69.33 -22.29 63.77 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.691 -174.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -66.69 -39.77 88.25 Favored 'General case' 0 N--CA 1.425 -1.675 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.203 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.8 p -107.82 -14.71 14.72 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 69.54 27.17 4.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 122.136 0.97 . . . . 0.0 108.998 -178.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.471 HD22 ' HA ' ' A' ' 108' ' ' PRO . 22.6 mt -127.71 167.44 16.45 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-N 114.218 -1.356 . . . . 0.0 107.978 -178.67 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.545 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 27.7 ttpt -121.84 136.48 54.93 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.762 -177.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.6 m -120.1 145.33 47.0 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 115.175 -0.921 . . . . 0.0 111.565 -175.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -130.32 129.34 43.07 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 176.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.07 138.57 48.55 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.7 152.58 23.14 Favored Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.066 -178.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 23.0 t -145.66 146.02 31.14 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.026 0.441 . . . . 0.0 110.703 -179.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.0 tm? -68.11 123.06 19.61 Favored 'General case' 0 N--CA 1.406 -2.632 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.492 176.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.462 ' HD3' ' HB2' ' A' ' 70' ' ' GLN . 59.6 mtmt -85.75 -48.18 9.05 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 120.905 0.383 . . . . 0.0 110.715 -178.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -161.67 144.44 12.03 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.047 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -132.99 151.78 52.03 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.429 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tp -83.18 169.85 15.35 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -65.5 -27.4 68.45 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.586 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -105.13 45.74 0.95 Allowed 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.555 0.693 . . . . 0.0 109.41 177.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -150.34 115.16 5.28 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.059 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -103.37 117.24 34.03 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.563 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' CYS . . . . . 0.453 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 83.8 m -141.05 145.9 36.48 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.068 0.461 . . . . 0.0 111.582 -178.195 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.61 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 20.1 pm0 -66.76 150.08 49.63 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.377 175.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -76.72 -36.53 57.11 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.198 -173.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' THR . . . . . 0.45 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 5.4 t -152.57 149.53 28.58 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 119.296 -0.961 . . . . 0.0 113.378 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 17.0 m -136.39 140.64 43.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.94 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 11.0 t -128.85 136.69 50.81 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.507 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 12.9 tt -140.33 140.69 34.29 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 121.159 0.504 . . . . 0.0 111.249 -178.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 18.6 m -120.43 128.46 53.21 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.018 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -131.32 115.78 16.3 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.394 -179.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.471 ' HA ' HD22 ' A' ' 83' ' ' LEU . 77.0 Cg_exo -51.26 127.63 22.73 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.524 2.149 . . . . 0.0 112.078 178.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.545 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 86.0 m -65.68 -50.22 65.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.806 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.224 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.666 179.191 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.591 ' N ' ' HG1' ' A' ' 40' ' ' THR . . . . . . . . 0 N--CA 1.445 -0.75 0 CA-C-O 121.041 0.245 . . . . 0.0 113.067 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.57 ' CD ' ' H ' ' A' ' 17' ' ' GLU . 1.4 pm0 -85.45 170.66 12.46 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 123.791 0.836 . . . . 0.0 111.438 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.541 ' HA ' ' O ' ' A' ' 38' ' ' THR . 66.1 m95 -46.77 119.86 2.69 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.692 0.758 . . . . 0.0 112.888 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 93.5 mt-30 -116.1 115.12 25.5 Favored 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 175.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -101.13 146.55 27.33 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -175.006 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.0 t -91.98 174.98 7.04 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 114.53 -1.213 . . . . 0.0 109.334 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.9 m -93.13 153.46 3.33 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.325 -175.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.437 ' SG ' ' HD3' ' A' ' 35' ' ' ARG . 34.0 m -84.23 112.04 19.92 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.785 -176.029 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.48 ' O ' ' HA3' ' A' ' 33' ' ' GLY . 6.9 m -106.86 102.76 44.15 Favored Pre-proline 0 N--CA 1.435 -1.201 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 174.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.544 ' O ' ' HB ' ' A' ' 26' ' ' THR . 26.3 Cg_endo -62.18 -16.55 51.43 Favored 'Trans proline' 0 C--O 1.218 -0.484 0 C-N-CA 122.839 2.359 . . . . 0.0 112.553 -176.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.544 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 51.9 m 81.62 -14.53 0.79 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 122.544 1.164 . . . . 0.0 108.875 177.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.503 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 16.7 t -142.37 -145.46 0.17 Allowed 'General case' 0 N--CA 1.411 -2.414 0 CA-C-N 113.767 -1.561 . . . . 0.0 109.113 -178.697 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -151.93 -42.25 0.02 OUTLIER Glycine 0 CA--C 1.482 -2.023 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -102.98 66.54 0.92 Allowed 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.38 0.61 . . . . 0.0 110.797 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.2 m 75.29 76.43 0.1 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.463 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.503 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -127.89 154.94 19.98 Favored Glycine 0 N--CA 1.44 -1.04 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 177.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.469 HD21 HH11 ' A' ' 52' ' ' ARG . 55.7 tp -83.76 125.42 31.89 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.739 0.269 . . . . 0.0 110.893 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.48 ' HA3' ' O ' ' A' ' 24' ' ' VAL . . . -139.17 164.74 25.83 Favored Glycine 0 CA--C 1.505 -0.564 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 -177.062 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 6.8 m -145.69 154.92 42.62 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -174.445 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.437 ' HD3' ' SG ' ' A' ' 23' ' ' CYS . 23.5 ptt180 -134.9 154.32 51.72 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.759 176.112 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.444 ' HG2' HG22 ' A' ' 50' ' ' THR . 25.3 mt-10 -115.96 131.72 56.86 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.148 -177.05 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -122.46 151.07 16.89 Favored Glycine 0 CA--C 1.52 0.357 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.541 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 14.2 p -134.32 155.03 50.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.429 0.614 . . . . 0.0 111.471 -177.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.539 ' HG2' ' N ' ' A' ' 40' ' ' THR . 17.5 ttt180 -151.49 160.47 43.69 Favored 'General case' 0 C--O 1.217 -0.609 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.427 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.596 HG22 ' HA ' ' A' ' 44' ' ' CYS . 0.2 OUTLIER -133.71 155.34 49.92 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 174.908 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -106.39 -152.11 19.35 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 111.095 -0.802 . . . . 0.0 111.095 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.58 -33.63 53.86 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 117.062 0.431 . . . . 0.0 111.649 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -84.94 1.68 46.25 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -177.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.596 ' HA ' HG22 ' A' ' 40' ' ' THR . 66.4 m 57.78 32.87 22.52 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.873 0.368 . . . . 0.0 111.422 -178.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -68.36 -23.54 64.7 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.312 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 72.25 105.46 0.07 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.635 0.731 . . . . 0.0 112.278 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 m -105.15 145.11 31.02 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.269 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 26.0 ttt -139.54 148.25 42.34 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.555 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -143.35 136.34 27.78 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.444 HG22 ' HG2' ' A' ' 36' ' ' GLU . 13.0 p -116.62 135.9 53.41 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 55.7 tp60 -137.86 138.24 38.9 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 120.364 -0.535 . . . . 0.0 111.386 -177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.469 HH11 HD21 ' A' ' 32' ' ' LEU . 39.6 mtt180 -87.37 131.5 34.26 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 85.4 m -82.36 160.64 22.77 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -113.69 135.38 54.0 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-O 121.259 0.552 . . . . 0.0 112.113 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 31' ' ' GLY . 4.0 mp -111.16 126.22 29.08 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.751 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -70.08 103.18 1.18 Allowed 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.487 2.125 . . . . 0.0 111.349 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 4.6 t . . . . . 0 C--N 1.316 -0.89 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.213 -177.977 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.891 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.5 -32.88 74.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.625 0.25 . . . . 0.0 111.625 -178.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -84.76 -13.4 51.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.968 0.413 . . . . 0.0 111.027 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 82.0 m -81.91 158.86 23.8 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.704 ' O ' ' HA ' ' A' ' 90' ' ' LEU . 47.6 mtpt -128.19 127.68 43.37 Favored 'General case' 0 CA--C 1.498 -1.025 0 C-N-CA 119.631 -0.828 . . . . 0.0 110.896 -176.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 100' ' ' GLN . 79.0 m-85 -124.8 129.33 50.24 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.894 -175.034 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -112.07 129.75 56.11 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -94.14 135.7 35.24 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.979 0.419 . . . . 0.0 110.924 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.19 162.97 13.58 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.916 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.65 92.27 3.22 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.713 -177.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 43.0 p-90 -92.45 -18.07 23.71 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.525 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -167.27 110.77 0.41 Allowed Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.991 -0.843 . . . . 0.0 110.991 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -95.53 115.84 28.0 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-O 120.792 0.329 . . . . 0.0 111.774 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.622 ' H ' ' HG3' ' A' ' 84' ' ' LYS . 13.5 t 60.76 107.72 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.744 -1.116 . . . . 0.0 112.428 175.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.55 ' OD2' HG22 ' A' ' 81' ' ' THR . 27.3 t70 -82.16 131.16 35.24 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.789 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.8 mt -72.39 -32.41 66.37 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.559 -176.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -69.13 -42.42 76.04 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.288 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.568 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 10.0 t -105.99 -1.61 23.79 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -175.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 55.06 32.47 18.32 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -178.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 81' ' ' THR . 24.0 mt -127.1 164.33 21.82 Favored 'General case' 0 CA--C 1.497 -1.081 0 O-C-N 121.845 -0.535 . . . . 0.0 110.143 -178.073 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.622 ' HG3' ' H ' ' A' ' 77' ' ' CYS . 77.5 tttt -120.64 136.68 54.76 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -177.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 4.2 m -119.35 144.24 46.97 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.567 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -139.48 141.19 37.4 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.089 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.2 m -120.93 145.5 47.63 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.091 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -144.55 157.16 27.14 Favored Glycine 0 N--CA 1.443 -0.849 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.9 m -145.61 149.64 34.89 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.62 0.21 . . . . 0.0 111.206 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.768 HD12 ' HA ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -69.46 129.97 41.2 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.003 0.43 . . . . 0.0 110.219 177.595 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -92.65 -32.72 14.65 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 120.906 0.384 . . . . 0.0 110.91 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.94 143.93 31.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -134.65 145.46 48.6 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.71 0.291 . . . . 0.0 110.822 -176.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.7 mp -91.4 174.73 7.22 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.233 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -88.95 -17.25 29.88 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.105 0.478 . . . . 0.0 110.833 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -101.86 28.03 6.03 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.274 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -164.01 117.79 1.47 Allowed 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.983 -176.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -82.03 111.27 18.03 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 174.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 80.4 m -94.3 165.21 12.7 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.37 0.605 . . . . 0.0 112.262 -175.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.497 ' O ' ' HB3' ' A' ' 90' ' ' LEU . 88.4 mt-30 -87.04 124.62 33.41 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.251 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.768 ' HA ' HD12 ' A' ' 90' ' ' LEU . 20.1 pttm -74.79 -31.96 61.88 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.412 -178.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.9 t -158.88 149.22 19.63 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-O 121.463 0.649 . . . . 0.0 111.389 175.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 13.7 m -141.5 139.47 32.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.063 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.5 m -129.04 131.67 47.38 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.108 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 22.4 pt -135.47 145.63 31.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 CA-C-O 120.625 0.25 . . . . 0.0 110.453 -177.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 84' ' ' LYS . 6.5 p -122.55 134.38 54.54 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.872 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -126.03 132.32 24.27 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.888 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.42 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 30.8 Cg_endo -64.03 124.47 13.56 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.049 1.833 . . . . 0.0 112.233 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 94.9 m -73.12 -17.85 61.35 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.235 0.541 . . . . 0.0 109.822 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.536 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 178.083 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.031 0 N-CA-C 112.034 -0.426 . . . . 0.0 112.034 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -107.83 164.55 12.15 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -56.98 123.55 15.54 Favored 'General case' 0 N--CA 1.427 -1.592 0 O-C-N 123.528 0.518 . . . . 0.0 111.109 173.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.571 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 74.3 mt-30 -115.95 115.45 26.19 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -104.26 143.61 32.73 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 t -104.38 171.59 7.25 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.87 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.8 m -94.61 154.82 3.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.6 t -56.16 114.15 1.84 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.325 -178.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 10.5 m -109.99 120.81 43.63 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.989 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.97 129.58 19.87 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 122.786 2.324 . . . . 0.0 113.731 -177.311 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.485 ' HB ' ' O ' ' A' ' 32' ' ' LEU . 94.9 m -77.75 -22.51 50.17 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.227 176.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.585 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 17.9 t -159.71 116.91 2.62 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.65 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.9 -32.73 80.79 Favored Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.746 -0.661 . . . . 0.0 113.088 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -76.38 52.68 0.79 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.566 0.222 . . . . 0.0 111.371 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.491 ' HA ' HD13 ' A' ' 55' ' ' ILE . 42.5 t 65.95 80.98 0.21 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.141 179.15 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.585 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -148.87 157.11 27.14 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.3 -0.952 . . . . 0.0 114.191 -177.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.485 ' O ' ' HB ' ' A' ' 26' ' ' THR . 4.3 mm? -49.26 158.42 0.38 Allowed 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 124.465 1.106 . . . . 0.0 112.459 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.1 176.71 19.85 Favored Glycine 0 N--CA 1.434 -1.496 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -178.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.4 p -140.35 156.19 46.51 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 118.24 1.02 . . . . 0.0 113.049 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 70.9 mtt-85 -135.62 138.47 42.94 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.749 -1.114 . . . . 0.0 108.542 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -124.85 131.31 53.45 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 120.858 0.361 . . . . 0.0 111.583 -177.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.571 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -133.42 137.33 9.27 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.6 p -132.04 152.8 50.96 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 117.439 0.619 . . . . 0.0 111.083 -177.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.41 ' HG2' ' N ' ' A' ' 40' ' ' THR . 68.7 ttt180 -155.17 160.77 41.16 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.41 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 6.2 p -117.88 161.85 19.08 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.042 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.42 ' H ' ' N ' ' A' ' 45' ' ' LYS . . . -81.11 -173.03 47.15 Favored Glycine 0 C--N 1.322 -0.248 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.222 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.79 -33.47 72.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.983 0.42 . . . . 0.0 110.983 -178.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -97.7 18.12 16.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.497 0.665 . . . . 0.0 109.414 176.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 72.4 m 69.06 60.04 0.34 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.954 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.469 ' HG3' ' H ' ' A' ' 46' ' ' GLN . 14.4 tptm -77.6 -145.87 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.814 176.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.469 ' H ' ' HG3' ' A' ' 45' ' ' LYS . 52.2 tt0 -150.1 116.09 5.64 Favored 'General case' 0 N--CA 1.412 -2.342 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 -178.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.0 m -133.47 122.18 23.28 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 57.0 mtm -129.0 134.97 48.36 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.912 0.387 . . . . 0.0 111.114 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -132.25 130.33 40.79 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.541 177.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 p -130.8 131.3 44.58 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 176.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -124.93 141.97 51.77 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 121.105 0.478 . . . . 0.0 110.231 -176.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -85.45 110.72 19.37 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 122.451 1.12 . . . . 0.0 112.232 -177.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.2 t -68.66 147.23 52.18 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 113.063 -1.88 . . . . 0.0 109.867 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.0 tttm -114.07 142.14 46.57 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-O 120.753 0.311 . . . . 0.0 110.552 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.491 HD13 ' HA ' ' A' ' 30' ' ' CYS . 17.9 tt -97.91 130.89 27.76 Favored Pre-proline 0 C--N 1.308 -1.197 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -51.0 -52.65 8.64 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.974 2.449 . . . . 0.0 112.242 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 6.3 t . . . . . 0 CA--C 1.536 0.44 0 O-C-N 123.764 0.665 . . . . 0.0 110.886 179.435 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.455 0 N-CA-C 112.634 -0.186 . . . . 0.0 112.634 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 62.55 15.69 8.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.047 0.539 . . . . 0.0 111.719 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -84.25 -5.63 59.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.363 0.601 . . . . 0.0 110.293 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 50.0 m -136.52 -160.68 1.08 Allowed 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -127.11 137.05 52.92 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.047 0.385 . . . . 0.0 110.134 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -123.26 150.24 43.75 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.995 -178.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.9 tm0? -125.51 125.43 43.25 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -94.18 131.43 39.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.199 0.523 . . . . 0.0 112.141 -176.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -97.25 163.79 12.76 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.84 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -126.66 79.32 1.86 Allowed 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.109 -178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 42.2 t-105 -82.32 -26.31 33.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.238 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -143.78 157.14 26.95 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.574 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -96.32 147.92 23.3 Favored 'General case' 0 N--CA 1.437 -1.113 0 C-N-CA 123.167 0.587 . . . . 0.0 110.15 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 40.5 t -30.63 137.38 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 O-C-N 124.203 0.939 . . . . 0.0 111.428 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -77.85 122.04 24.92 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 121.516 0.674 . . . . 0.0 109.841 -176.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.8 mt -70.7 -33.12 70.55 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 114.609 -1.178 . . . . 0.0 112.091 -173.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -71.67 -37.49 70.76 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.496 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.513 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 68.1 p -104.32 -8.01 19.57 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -172.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 57.27 34.5 24.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.275 0.56 . . . . 0.0 110.528 -175.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 81' ' ' THR . 44.1 mt -126.98 147.3 50.12 Favored 'General case' 0 CA--C 1.496 -1.11 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.094 -178.268 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.752 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 81.4 tttt -124.77 137.26 54.33 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.703 -178.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 52.3 m -119.12 143.76 47.0 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 -134.73 140.55 46.03 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.0 m -109.81 143.72 39.26 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -136.39 167.28 24.52 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 120.462 -0.875 . . . . 0.0 111.393 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.8 p -135.22 144.28 46.83 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 120.626 0.25 . . . . 0.0 110.7 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.599 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 2.9 tm? -70.76 122.87 20.66 Favored 'General case' 0 N--CA 1.409 -2.492 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -97.35 -37.54 9.99 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.957 0.408 . . . . 0.0 110.853 -177.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -155.64 135.06 12.4 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.234 178.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -126.18 144.78 50.63 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 42.9 mt -87.24 174.39 8.62 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.394 0.616 . . . . 0.0 111.535 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -73.64 -26.7 60.89 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.48 -178.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -105.05 35.94 2.64 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.613 0.72 . . . . 0.0 109.495 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -154.11 134.57 13.47 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.921 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -112.31 122.46 47.79 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 70.7 m -139.72 141.31 36.92 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.205 0.526 . . . . 0.0 111.599 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.599 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 3.0 pm0 -68.72 154.27 42.26 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.81 176.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.4 pttm -74.07 -26.55 60.45 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.555 -175.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.5 t -140.63 150.95 44.2 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.324 -0.55 . . . . 0.0 111.665 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 15.8 m -138.87 149.48 23.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.24 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 97.2 m -129.24 136.61 50.33 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.42 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tt -140.7 141.31 32.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 120.84 0.352 . . . . 0.0 110.614 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 57.6 m -121.16 134.8 55.23 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -134.27 133.94 22.24 Favored Pre-proline 0 C--N 1.313 -0.983 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.429 -178.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.43 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 32.7 Cg_exo -58.12 131.03 40.93 Favored 'Trans proline' 0 C--O 1.244 0.777 0 C-N-CA 121.924 1.75 . . . . 0.0 111.504 175.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.752 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 69.8 m -81.77 173.55 12.18 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.325 0.583 . . . . 0.0 111.576 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.151 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 -179.561 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.755 0 CA-C-O 120.855 0.142 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -76.2 169.66 17.79 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 122.93 0.492 . . . . 0.0 111.253 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.522 ' HA ' ' O ' ' A' ' 38' ' ' THR . 81.6 m95 -48.57 118.93 2.75 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.417 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.453 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 6.8 pt20 -120.14 115.44 23.66 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 89.7 m95 -100.8 146.41 27.32 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.803 -175.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 m -94.53 171.8 8.58 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 114.79 -1.095 . . . . 0.0 108.998 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.5 m -91.93 154.79 3.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -177.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.8 t -74.45 116.47 15.16 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.805 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.0 t -111.44 117.87 48.39 Favored Pre-proline 0 N--CA 1.434 -1.246 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 179.431 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.32 143.66 75.26 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.533 2.155 . . . . 0.0 112.373 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.436 ' HB ' ' O ' ' A' ' 32' ' ' LEU . 23.7 m -90.3 -23.8 21.06 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.354 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.4 t -134.62 173.63 11.45 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.074 179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.94 74.57 0.25 Allowed Glycine 0 N--CA 1.448 -0.565 0 O-C-N 123.683 0.614 . . . . 0.0 113.617 -177.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.7 t70 68.93 23.87 6.56 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-O 121.9 0.857 . . . . 0.0 110.826 174.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.502 ' HA ' ' HB2' ' A' ' 57' ' ' CYS . 9.0 t -150.92 10.35 0.61 Allowed 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.619 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.482 ' O ' HG13 ' A' ' 55' ' ' ILE . . . -126.51 126.1 5.62 Favored Glycine 0 CA--C 1.494 -1.229 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.539 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 53' ' ' CYS . 1.2 mp -51.64 152.4 2.81 Favored 'General case' 0 C--O 1.207 -1.158 0 O-C-N 124.176 0.574 . . . . 0.0 111.483 -179.028 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.07 -175.19 14.79 Favored Glycine 0 CA--C 1.496 -1.154 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 -173.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.2 p -136.8 154.14 50.62 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 117.816 0.808 . . . . 0.0 112.207 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -126.23 137.63 53.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 175.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -113.9 131.41 56.3 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.569 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.453 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -137.7 141.7 12.51 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.522 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 22.8 p -123.79 154.78 39.06 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.954 0.377 . . . . 0.0 110.658 -179.554 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.522 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 9.4 tpt180 -145.18 159.95 42.21 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.403 ' OG1' ' HA ' ' A' ' 44' ' ' CYS . 11.1 t -115.84 162.22 17.63 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-O 122.173 0.987 . . . . 0.0 112.225 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.41 -164.15 11.23 Favored Glycine 0 C--N 1.286 -2.24 0 CA-C-N 113.432 -1.713 . . . . 0.0 108.839 175.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.17 -25.97 66.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 118.254 1.027 . . . . 0.0 111.872 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -99.73 -11.34 20.94 Favored 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 120.182 -0.607 . . . . 0.0 111.364 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.403 ' HA ' ' OG1' ' A' ' 40' ' ' THR . 93.8 m 68.29 152.17 0.09 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptp 63.25 10.8 4.9 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.832 175.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -103.57 18.12 22.57 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.42 ' HB ' ' O ' ' A' ' 39' ' ' ARG . 11.9 m -143.62 110.44 5.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.549 0.69 . . . . 0.0 112.01 178.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 24.2 ttt -146.23 135.11 22.46 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.045 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -143.05 142.76 31.64 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.12 0.486 . . . . 0.0 111.397 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.1 m -118.4 136.58 53.68 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.08 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -128.73 141.19 51.4 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 110.264 -0.272 . . . . 0.0 110.264 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 84.1 mtt180 -86.91 139.49 30.58 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.441 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 1.5 p -99.96 -170.18 1.85 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -113.49 138.42 50.15 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.655 0.264 . . . . 0.0 110.75 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 31' ' ' GLY . 22.0 mm -126.69 111.15 22.63 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.273 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.76 122.92 9.59 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.569 2.179 . . . . 0.0 111.411 177.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.502 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 42.6 t . . . . . 0 C--N 1.322 -0.604 0 CA-C-O 120.663 0.268 . . . . 0.0 110.986 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.727 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.06 -56.89 2.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.017 0.436 . . . . 0.0 110.596 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -89.17 -19.72 25.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.879 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 99.0 m -80.72 116.52 20.77 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.539 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -112.98 130.33 56.17 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.696 ' CE1' HD23 ' A' ' 90' ' ' LEU . 4.6 m-85 -106.58 152.36 23.82 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.374 -177.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.447 ' O ' ' HA2' ' A' ' 88' ' ' GLY . 6.4 tp-100 -103.34 117.05 33.61 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 174.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -94.52 118.74 32.14 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -175.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -122.34 162.97 20.55 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.373 177.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.52 141.63 28.47 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-O 120.972 0.415 . . . . 0.0 111.037 -176.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 40.6 t-105 -97.65 -5.3 35.67 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 148.85 -170.57 29.25 Favored Glycine 0 N--CA 1.427 -1.94 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.873 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -95.68 148.48 22.5 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 124.04 0.936 . . . . 0.0 109.09 179.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 13.8 m -22.98 125.18 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.358 0 O-C-N 124.225 0.953 . . . . 0.0 112.447 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -80.33 120.46 24.41 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.1 mt -70.22 -28.33 65.18 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.304 -0.862 . . . . 0.0 112.302 -174.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -70.7 -37.38 73.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.029 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.611 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.5 p -105.37 -9.41 17.59 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -174.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.98 25.72 14.16 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.422 0.689 . . . . 0.0 110.972 -175.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 81' ' ' THR . 13.9 mt -126.86 162.41 25.95 Favored 'General case' 0 CA--C 1.5 -0.968 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.49 -177.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.623 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 34.9 ttpt -118.93 147.84 43.59 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.1 m -119.27 142.48 48.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.841 0.353 . . . . 0.0 110.479 -176.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.0 tpt180 -135.22 141.03 45.73 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -178.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.7 m -118.43 144.69 45.78 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.486 -178.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.447 ' HA2' ' O ' ' A' ' 70' ' ' GLN . . . -136.29 150.28 20.4 Favored Glycine 0 N--CA 1.435 -1.379 0 C-N-CA 120.195 -1.002 . . . . 0.0 111.938 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 25.8 m -127.36 134.29 49.97 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 120.981 0.419 . . . . 0.0 111.903 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.696 HD23 ' CE1' ' A' ' 69' ' ' TYR . 2.8 tm? -74.4 127.49 33.16 Favored 'General case' 0 N--CA 1.427 -1.62 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.235 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -86.77 -50.75 6.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.567 -177.205 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -144.08 142.02 30.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.83 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.526 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -135.18 140.02 45.02 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.7 mp -89.12 175.92 7.18 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 120.915 0.388 . . . . 0.0 110.582 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -83.23 0.52 45.16 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.909 0.385 . . . . 0.0 111.578 -176.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -101.19 15.14 29.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.162 0.506 . . . . 0.0 110.339 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -173.9 123.64 0.34 Allowed 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.04 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -93.58 110.14 21.75 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.331 0.586 . . . . 0.0 109.654 177.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 75.7 m -109.91 133.05 53.59 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.114 -177.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -66.96 150.81 48.71 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.01 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -74.82 -29.63 61.13 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.939 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.7 t -146.05 150.06 35.27 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.766 0.793 . . . . 0.0 112.263 178.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 28.7 m -135.49 146.87 29.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.316 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 95.8 m -128.43 127.68 43.0 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 13.5 tt -136.02 148.62 27.65 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 CA-C-O 120.818 0.342 . . . . 0.0 110.611 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 84' ' ' LYS . 54.6 m -130.3 135.68 48.34 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.097 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -133.26 148.59 69.68 Favored Pre-proline 0 C--N 1.319 -0.745 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.876 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.488 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 34.4 Cg_exo -59.63 131.98 43.16 Favored 'Trans proline' 0 CA--C 1.516 -0.408 0 C-N-CA 122.63 2.22 . . . . 0.0 113.022 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.623 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 78.8 m -75.31 -17.02 60.37 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.349 0.595 . . . . 0.0 109.938 176.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.105 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 177.022 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.616 ' N ' ' HG1' ' A' ' 40' ' ' THR . . . . . . . . 0 N--CA 1.441 -0.997 0 CA-C-O 121.392 0.44 . . . . 0.0 114.115 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -73.97 167.95 20.48 Favored 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 123.915 0.886 . . . . 0.0 111.816 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -49.4 125.14 10.52 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 114.648 -1.16 . . . . 0.0 112.159 178.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -115.5 123.06 47.57 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -102.83 133.11 48.45 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.167 0.508 . . . . 0.0 111.781 -175.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.9 p -96.11 170.09 9.51 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.654 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.3 m -87.23 131.01 36.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 122.494 1.14 . . . . 0.0 111.555 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 35' ' ' ARG . 50.9 t -81.15 135.85 35.83 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 112.947 -1.933 . . . . 0.0 112.779 -175.064 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.496 ' O ' ' HA3' ' A' ' 33' ' ' GLY . 57.5 t -100.44 100.65 12.59 Favored Pre-proline 0 N--CA 1.438 -1.054 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 171.48 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.564 ' O ' ' HB ' ' A' ' 26' ' ' THR . 72.3 Cg_endo -74.89 0.92 8.25 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.782 2.321 . . . . 0.0 113.361 -174.104 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.564 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 17.0 m 80.9 -39.09 0.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.794 0.438 . . . . 0.0 110.611 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.1 t 75.21 179.56 0.19 Allowed 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.616 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.21 8.05 48.15 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.023 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 64.09 10.01 5.1 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.428 0.691 . . . . 0.0 111.577 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 59.2 m -159.14 30.55 0.21 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -109.14 140.11 15.52 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 119.898 -1.144 . . . . 0.0 113.443 -174.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.463 HD12 ' O ' ' A' ' 53' ' ' CYS . 47.6 tp -100.52 127.04 47.0 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 176.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.496 ' HA3' ' O ' ' A' ' 24' ' ' VAL . . . -126.7 -173.49 13.55 Favored Glycine 0 C--N 1.316 -0.544 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.416 HG22 ' HG2' ' A' ' 52' ' ' ARG . 1.3 p -137.02 153.32 50.67 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 118.893 1.346 . . . . 0.0 112.986 -178.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.479 ' HB2' ' HB2' ' A' ' 23' ' ' CYS . 45.3 ttm180 -131.57 137.91 48.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.614 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.438 ' HG2' HG22 ' A' ' 50' ' ' THR . 42.9 mt-10 -115.35 130.41 56.89 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 120.679 0.276 . . . . 0.0 111.029 -178.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -127.88 135.71 8.82 Favored Glycine 0 N--CA 1.435 -1.405 0 N-CA-C 109.038 -1.625 . . . . 0.0 109.038 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 29.8 m -129.06 148.48 51.01 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 117.964 0.882 . . . . 0.0 110.361 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -142.63 162.03 36.53 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.616 ' HG1' ' N ' ' A' ' 16' ' ' GLY . 0.6 OUTLIER -142.78 145.21 33.03 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 175.348 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -101.65 -158.52 26.73 Favored Glycine 0 N--CA 1.437 -1.235 0 C-N-CA 120.069 -1.062 . . . . 0.0 112.155 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.18 -31.54 72.01 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.15 0.5 . . . . 0.0 110.325 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.5 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 27.9 mm-40 -89.49 2.45 54.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.831 178.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 35.89 59.37 0.88 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -174.339 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 74.5 mmtt -128.62 143.43 50.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.884 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.513 ' HG3' ' H ' ' A' ' 47' ' ' THR . 18.7 pt20 36.02 -108.7 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.575 1.15 . . . . 0.0 113.886 -178.277 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.513 ' H ' ' HG3' ' A' ' 46' ' ' GLN . 3.0 p 46.35 45.59 13.4 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.891 0.876 . . . . 0.0 113.189 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -125.48 138.34 53.99 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.808 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -136.18 143.75 44.6 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 121.011 0.434 . . . . 0.0 110.385 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.438 HG22 ' HG2' ' A' ' 36' ' ' GLU . 16.6 p -117.65 137.46 52.63 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.258 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 66.5 mm-40 -122.24 151.81 40.67 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -177.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HG2' HG22 ' A' ' 34' ' ' THR . 83.8 mtm180 -107.92 126.98 53.33 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 176.475 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.463 ' O ' HD12 ' A' ' 32' ' ' LEU . 36.3 m -88.32 125.23 34.58 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -111.85 138.87 47.87 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 121.124 0.488 . . . . 0.0 112.041 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.1 mm -114.19 106.05 53.43 Favored Pre-proline 0 N--CA 1.436 -1.148 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -64.67 100.44 0.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.187 1.924 . . . . 0.0 111.358 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.8 t . . . . . 0 C--N 1.32 -0.71 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.897 -178.261 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.578 ' HA3' ' CG ' ' A' ' 69' ' ' TYR . . . . . . . . 0 N--CA 1.449 -0.498 0 N-CA-C 112.643 -0.183 . . . . 0.0 112.643 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.71 -13.51 48.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 0.0 110.743 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -88.96 -5.26 58.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.397 0.618 . . . . 0.0 109.706 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 10.1 p -147.44 -118.08 0.07 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.703 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 92' ' ' ARG . 62.9 mttp -133.38 125.9 30.13 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 122.204 -0.31 . . . . 0.0 110.453 178.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.578 ' CG ' ' HA3' ' A' ' 64' ' ' GLY . 0.3 OUTLIER -130.94 152.9 49.76 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.174 0.511 . . . . 0.0 111.877 -175.997 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -103.27 118.43 36.76 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.22 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -97.6 114.62 26.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -175.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.422 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 6.6 tt0 -123.63 136.83 54.72 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.636 175.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 57.08 36.32 27.5 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.545 0.688 . . . . 0.0 111.179 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -86.62 -23.9 25.54 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.718 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.03 -88.36 0.08 OUTLIER Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 116.054 1.181 . . . . 0.0 116.054 -175.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -117.47 143.88 45.59 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -169.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 8.4 t -69.8 159.32 33.81 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.759 175.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -94.32 115.91 28.2 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-O 121.354 0.597 . . . . 0.0 111.108 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.501 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.6 pt? -71.16 -30.61 66.66 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.958 -178.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -66.9 -33.26 75.2 Favored 'General case' 0 CA--C 1.496 -1.113 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.165 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.502 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 67.8 p -107.72 -8.33 16.11 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.045 -177.14 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.426 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 59.1 38.3 23.91 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.419 -175.136 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 81' ' ' THR . 81.0 mt -130.02 148.84 51.92 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.488 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.767 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 60.6 tttp -127.05 135.53 50.92 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.649 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -139.37 145.78 39.41 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.71 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -136.44 130.06 32.08 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.896 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.422 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 4.0 m -120.87 143.69 48.78 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.309 -179.02 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -149.84 152.34 24.28 Favored Glycine 0 N--CA 1.436 -1.356 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.899 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.8 m -146.12 144.19 29.83 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.379 -0.411 . . . . 0.0 111.58 177.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.677 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 4.9 tt -72.26 122.45 21.12 Favored 'General case' 0 N--CA 1.432 -1.365 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 176.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.469 ' HE2' ' O ' ' A' ' 69' ' ' TYR . 46.1 pttt -104.93 -12.58 16.15 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -178.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.575 ' HB2' ' HB2' ' A' ' 68' ' ' LYS . 21.2 mmt180 -150.94 134.19 16.12 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -111.17 132.64 54.15 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.411 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.457 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 10.3 mp -94.47 152.61 18.44 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.004 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -76.82 -10.37 59.33 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.95 0.405 . . . . 0.0 111.288 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -125.07 19.93 8.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.281 0.563 . . . . 0.0 111.05 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.457 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -156.23 112.25 3.03 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.701 -178.068 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -91.32 110.97 22.27 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' CYS . . . . . 0.466 ' HB2' ' CD1' ' A' ' 90' ' ' LEU . 91.2 m -101.53 162.64 12.75 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.65 0.738 . . . . 0.0 112.863 -177.075 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.677 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 11.2 pt20 -66.77 130.49 43.35 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.075 -1.421 . . . . 0.0 108.91 176.148 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.44 ' HA ' ' HB3' ' A' ' 90' ' ' LEU . 29.0 tptp -76.72 -44.97 31.24 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.173 -174.115 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.9 t -151.34 153.05 34.03 Favored 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 119.862 -0.735 . . . . 0.0 111.689 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 m -143.71 136.7 24.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.953 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 89.2 m -130.83 124.25 30.87 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.423 175.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.3 tt -140.6 136.56 35.72 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 CA-C-O 121.453 0.644 . . . . 0.0 111.323 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.8 m -126.56 131.37 51.56 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.44 178.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -133.59 106.99 11.89 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.815 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.12 125.01 16.99 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.33 2.02 . . . . 0.0 111.829 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.767 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 86.8 m -85.52 -178.04 6.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.549 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.112 0 N-CA-C 111.127 -0.789 . . . . 0.0 111.127 178.094 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.597 ' N ' ' HG1' ' A' ' 40' ' ' THR . . . . . . . . 0 N--CA 1.45 -0.407 0 CA-C-O 120.909 0.172 . . . . 0.0 113.192 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 19' ' ' GLN . 42.0 mm-40 -74.86 169.17 18.46 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.028 0.531 . . . . 0.0 111.737 -178.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.594 ' CD2' ' HB2' ' A' ' 39' ' ' ARG . 94.7 m95 -48.27 119.48 3.0 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.066 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 28.2 mt-30 -108.83 115.73 30.64 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 177.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -105.26 145.12 31.1 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-O 121.686 0.755 . . . . 0.0 112.95 -174.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -93.64 175.23 6.82 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.89 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.3 m -94.2 129.18 44.84 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -176.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.75 96.05 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.396 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -102.03 101.04 16.73 Favored Pre-proline 0 N--CA 1.439 -1.01 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.652 ' O ' ' HB ' ' A' ' 26' ' ' THR . 56.9 Cg_endo -71.98 -20.78 25.12 Favored 'Trans proline' 0 C--O 1.207 -1.07 0 C-N-CA 122.277 1.984 . . . . 0.0 111.068 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.652 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 7.8 m 107.41 -32.47 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.948 1.299 . . . . 0.0 110.155 177.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.9 t 75.51 -162.32 0.06 Allowed 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.482 175.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.97 -93.62 1.05 Allowed Glycine 0 CA--C 1.49 -1.53 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -175.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.459 ' O ' ' HB2' ' A' ' 30' ' ' CYS . 9.8 p-10 -160.13 58.93 0.35 Allowed 'General case' 0 C--N 1.284 -2.271 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 177.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 29' ' ' ASP . 83.3 m 83.14 97.41 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 112.717 -2.038 . . . . 0.0 110.135 -176.071 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -127.3 156.45 20.39 Favored Glycine 0 N--CA 1.434 -1.484 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.826 -178.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.5 tp -80.95 131.39 35.33 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.947 0.374 . . . . 0.0 110.29 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 25' ' ' PRO . . . -139.82 173.93 22.63 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 -176.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 p -143.55 160.14 41.16 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -174.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 35' ' ' ARG . 42.2 ttp180 -137.41 137.15 38.5 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.927 176.461 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.12 132.44 56.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.722 -0.217 . . . . 0.0 111.145 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -133.02 128.29 5.05 Favored Glycine 0 N--CA 1.445 -0.752 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 176.141 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.418 HG22 ' HB2' ' A' ' 48' ' ' MET . 66.5 p -130.99 146.9 52.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 117.532 0.666 . . . . 0.0 110.65 -176.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.594 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 6.7 ttp85 -143.83 155.51 44.15 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.597 ' HG1' ' N ' ' A' ' 16' ' ' GLY . 0.7 OUTLIER -149.44 144.0 26.06 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-O 120.781 0.324 . . . . 0.0 110.172 176.928 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.89 -173.48 49.41 Favored Glycine 0 CA--C 1.499 -0.925 0 N-CA-C 110.275 -1.13 . . . . 0.0 110.275 176.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.61 -30.91 69.02 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.342 0.591 . . . . 0.0 109.998 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -89.17 6.33 40.58 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.76 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 10.1 m 46.95 79.63 0.06 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.575 0.702 . . . . 0.0 112.589 -175.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.7 tptt -82.75 2.83 31.95 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.901 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.568 ' H ' HG22 ' A' ' 40' ' ' THR . 93.4 mt-30 48.67 56.27 7.85 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.915 -178.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 m -89.72 102.75 15.44 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.135 0.493 . . . . 0.0 109.937 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.418 ' HB2' HG22 ' A' ' 38' ' ' THR . 20.5 ptp -136.7 146.29 45.7 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-O 121.078 0.466 . . . . 0.0 111.902 -176.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.437 ' HA ' ' HE3' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -143.04 143.27 31.82 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.484 179.535 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 18.7 m -115.82 138.16 51.41 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.143 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -133.4 146.44 51.22 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.183 0.516 . . . . 0.0 111.518 -175.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -85.0 137.36 33.12 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 176.14 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.0 t -91.21 154.51 19.25 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 -177.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -112.85 138.87 49.04 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.219 0.533 . . . . 0.0 111.2 -176.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 4.9 tp -118.38 112.79 37.29 Favored Pre-proline 0 C--N 1.319 -0.729 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.888 -178.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.39 106.54 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.668 2.245 . . . . 0.0 112.079 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 79.7 m . . . . . 0 C--N 1.317 -0.807 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.146 -179.246 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.911 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -112.56 -62.95 1.5 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.937 0.398 . . . . 0.0 110.426 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.11 -5.51 25.58 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.535 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.457 ' SG ' HD21 ' A' ' 90' ' ' LEU . 11.8 t -76.78 167.82 21.16 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 176.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.415 ' O ' HD22 ' A' ' 90' ' ' LEU . 56.3 mttp -125.08 125.58 44.01 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.018 -177.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.417 ' HE1' ' HB2' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -124.56 153.56 41.95 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.802 -178.424 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -100.81 140.22 35.4 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.217 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -96.31 139.76 31.98 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.743 0.817 . . . . 0.0 109.008 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.404 HE21 ' HB3' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -77.97 164.76 24.81 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.75 28.97 1.25 Allowed 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -176.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 48.8 t-105 -87.31 -14.03 41.98 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.794 -175.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 108.11 127.07 5.56 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 119.884 -1.151 . . . . 0.0 111.075 -175.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -105.46 134.11 49.12 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-O 120.763 0.315 . . . . 0.0 111.547 -178.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 52.7 t 68.12 104.29 0.05 Allowed 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.809 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.485 ' HB2' ' OG1' ' A' ' 81' ' ' THR . 20.6 m-20 -87.49 112.06 21.81 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 177.284 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.38 -30.22 68.16 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.795 -175.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -67.83 -29.93 69.21 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.254 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.57 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.5 p -104.45 -8.23 19.27 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.566 -0.453 . . . . 0.0 111.163 -177.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.454 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 59.67 30.39 20.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.512 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 81' ' ' THR . 67.3 mt -129.06 160.37 33.0 Favored 'General case' 0 CA--C 1.498 -1.032 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.204 -175.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 109' ' ' CYS . 35.6 tttp -129.06 140.33 51.65 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.218 -178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.4 t -137.81 145.32 42.18 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.535 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 mtt180 -140.34 128.99 22.95 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.14 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.2 t -123.82 146.78 48.12 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.928 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -150.08 152.33 24.26 Favored Glycine 0 N--CA 1.437 -1.278 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.16 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.9 m -138.85 148.72 44.06 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.113 0.482 . . . . 0.0 111.976 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.7 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.3 tm? -79.49 126.14 30.47 Favored 'General case' 0 N--CA 1.423 -1.811 0 C-N-CA 123.939 0.895 . . . . 0.0 109.121 178.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -87.53 -33.77 18.84 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.326 -0.55 . . . . 0.0 112.325 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -160.71 141.03 11.36 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -105.22 152.51 22.77 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.935 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.689 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 3.2 mm? -91.02 176.21 6.68 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.889 0.376 . . . . 0.0 110.752 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -73.95 -27.85 61.21 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.888 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -130.45 43.69 3.08 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.697 0.761 . . . . 0.0 109.971 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.689 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -152.11 97.93 2.37 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.142 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -80.32 110.57 15.88 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 71.4 m -110.76 152.8 26.18 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.122 0.487 . . . . 0.0 111.607 -177.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.7 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 4.8 pm0 -68.46 132.71 47.47 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.677 177.414 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -74.25 -43.2 57.93 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 122.692 0.397 . . . . 0.0 111.333 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.3 t -155.52 146.41 22.35 Favored 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 119.216 -0.994 . . . . 0.0 112.101 175.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.0 m -133.13 138.56 51.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.545 176.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 58.3 m -129.83 127.85 41.11 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 114.726 -1.125 . . . . 0.0 108.993 177.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 19.8 pt -136.69 136.63 48.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-O 120.919 0.39 . . . . 0.0 111.163 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.6 t -126.85 135.36 50.88 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.909 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -135.53 130.98 19.16 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.415 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -52.33 126.53 20.85 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 121.27 1.313 . . . . 0.0 109.946 174.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 84' ' ' LYS . 33.7 t -101.33 -46.18 5.1 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -172.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.337 0 C-N-CA 121.085 -0.578 . . . . 0.0 113.095 -175.917 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.189 0 N-CA-C 111.667 -0.573 . . . . 0.0 111.667 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -106.31 -8.09 17.42 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.066 0.46 . . . . 0.0 110.337 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -75.98 -54.57 6.67 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.114 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 66.07 177.04 0.22 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.165 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.4 mttt 56.99 81.41 0.26 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.481 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.41 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 0.5 OUTLIER -93.38 -131.77 0.01 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 123.075 2.517 . . . . 0.0 110.873 179.02 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.41 ' H ' ' HB2' ' A' ' 6' ' ' PRO . 35.6 tt0 69.23 108.31 0.05 Allowed 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 123.776 0.83 . . . . 0.0 111.116 -179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -69.44 163.87 24.31 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.825 -177.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -73.54 148.12 43.33 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.883 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -133.58 147.59 30.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.268 0.556 . . . . 0.0 110.741 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -121.52 143.5 49.23 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.513 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -74.77 168.25 20.23 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.0 m 68.14 59.31 0.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.434 0.635 . . . . 0.0 109.777 -177.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.445 ' HA ' ' HA ' ' A' ' 42' ' ' ALA . 40.7 t0 -75.24 167.61 21.58 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.762 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.9 t -101.78 -55.21 2.56 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -176.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -157.44 159.88 30.13 Favored Glycine 0 N--CA 1.44 -1.039 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -92.91 166.27 12.48 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 117.085 0.443 . . . . 0.0 112.141 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.6 m95 -50.32 122.14 6.55 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.654 176.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -111.82 124.29 52.05 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.429 ' CE3' ' HA3' ' A' ' 37' ' ' GLY . 98.2 m95 -104.46 136.8 43.34 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.39 0.614 . . . . 0.0 112.169 -175.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.0 m -95.42 172.07 8.31 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.192 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.0 m -90.39 130.97 38.77 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 CA-C-O 121.756 0.788 . . . . 0.0 111.034 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 43.4 t -61.18 134.46 57.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.35 -1.295 . . . . 0.0 112.168 -176.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.9 t -96.8 107.93 39.99 Favored Pre-proline 0 N--CA 1.438 -1.045 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.56 ' O ' ' HB ' ' A' ' 26' ' ' THR . 18.1 Cg_endo -59.55 -19.03 50.3 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.935 2.423 . . . . 0.0 112.713 -176.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.56 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 30.7 m 85.98 -66.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.029 177.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.2 t 68.23 121.69 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.463 0.649 . . . . 0.0 111.081 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 161.05 66.53 0.02 OUTLIER Glycine 0 CA--C 1.494 -1.257 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.407 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 62.07 40.3 12.18 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 39.1 m 76.91 88.91 0.08 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.126 -178.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.63 149.43 16.87 Favored Glycine 0 CA--C 1.503 -0.665 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.4 tp -78.94 116.43 19.25 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.054 0.454 . . . . 0.0 112.089 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.31 162.32 34.9 Favored Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.085 178.294 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 p -136.13 154.53 50.95 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.465 0.65 . . . . 0.0 112.402 -177.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -125.21 138.44 54.12 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -118.77 129.08 55.05 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.905 0.383 . . . . 0.0 110.999 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.429 ' HA3' ' CE3' ' A' ' 20' ' ' TRP . . . -124.55 143.5 14.72 Favored Glycine 0 N--CA 1.437 -1.238 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 177.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.621 HG22 ' HB3' ' A' ' 48' ' ' MET . 50.7 p -133.3 158.41 43.02 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 117.637 0.719 . . . . 0.0 110.727 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.517 ' HG2' ' N ' ' A' ' 40' ' ' THR . 71.7 ttt180 -154.73 161.1 41.66 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.64 ' HA ' ' O ' ' A' ' 45' ' ' LYS . 1.3 p -106.58 145.79 31.47 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 174.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.89 -176.99 31.57 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.099 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . . . -70.39 -25.77 63.4 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.567 0.699 . . . . 0.0 110.441 -177.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -98.16 16.36 21.53 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.91 178.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 73.4 m 61.23 79.74 0.24 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.323 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.64 ' O ' ' HA ' ' A' ' 40' ' ' THR . 75.8 mmtt -130.36 146.03 51.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 177.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -74.75 108.46 7.51 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.03 0.443 . . . . 0.0 110.873 -177.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -115.8 136.59 52.91 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.621 ' HB3' HG22 ' A' ' 38' ' ' THR . 16.3 ptm -144.96 154.34 42.47 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -147.71 142.59 26.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.642 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.1 m -116.86 138.81 51.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 120.848 0.356 . . . . 0.0 110.476 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -120.48 152.66 37.71 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -104.78 127.35 52.55 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 57.6 m -90.69 -165.39 1.34 Allowed 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -175.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -117.55 140.06 50.12 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 120.772 0.32 . . . . 0.0 110.921 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 6.9 tp -109.77 120.22 45.53 Favored Pre-proline 0 C--N 1.305 -1.353 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.709 -178.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -62.51 103.44 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.368 2.045 . . . . 0.0 111.37 177.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.9 t -103.07 155.66 18.23 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.572 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.7 p-10 -72.25 145.48 47.9 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 121.164 -0.214 . . . . 0.0 110.6 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 88.9 m95 66.78 89.51 0.1 Allowed 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.687 0.756 . . . . 0.0 110.643 -177.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -101.11 -169.97 1.77 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.577 -178.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.451 ' HB3' ' NZ ' ' A' ' 61' ' ' LYS . 0.1 OUTLIER -78.42 52.17 1.12 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.366 0.603 . . . . 0.0 111.492 179.921 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -135.37 87.41 2.32 Favored 'General case' 0 N--CA 1.441 -0.89 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -84.72 15.74 3.69 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.819 -176.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -177.61 164.23 33.19 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.505 -0.855 . . . . 0.0 112.797 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -156.2 -79.87 0.08 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -89.6 -20.72 23.39 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.403 ' HA ' HD13 ' A' ' 94' ' ' LEU . 45.0 t -76.24 178.74 6.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.425 176.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -132.76 125.82 31.02 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.53 -178.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.438 ' HE1' ' O ' ' A' ' 100' ' ' GLN . 1.6 t80 -141.23 141.36 34.02 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.766 -177.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -123.7 134.02 53.79 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 110.498 -0.186 . . . . 0.0 110.498 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -97.09 131.64 43.67 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 176.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.485 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 3.6 pt20 -115.66 161.75 18.23 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -135.97 106.04 6.31 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 121.141 0.496 . . . . 0.0 111.288 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 59.3 t90 -79.06 -21.7 46.41 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.211 176.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -159.59 158.46 29.64 Favored Glycine 0 N--CA 1.434 -1.492 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.191 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -94.33 146.63 23.91 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 2.1 t -21.33 126.58 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.225 0 O-C-N 124.563 1.164 . . . . 0.0 112.58 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -98.29 109.16 21.96 Favored 'General case' 0 CA--C 1.494 -1.207 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 mt -75.51 -21.21 58.19 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -177.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -67.17 -36.48 81.89 Favored 'General case' 0 CA--C 1.486 -1.496 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -174.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 74.1 p -104.87 -7.28 19.48 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.875 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.425 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 61.95 37.31 15.15 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.348 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.458 ' HA ' ' H ' ' A' ' 109' ' ' CYS . 66.3 mt -128.1 152.31 48.14 Favored 'General case' 0 CA--C 1.498 -1.057 0 CA-C-O 121.276 0.56 . . . . 0.0 111.873 -176.067 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 109' ' ' CYS . 87.0 tttt -135.65 136.48 41.0 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.725 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.1 t -134.52 144.49 48.05 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 120.904 0.383 . . . . 0.0 111.551 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -142.54 142.87 32.28 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.925 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.485 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 5.0 m -112.61 147.21 37.16 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.651 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -133.82 156.49 22.34 Favored Glycine 0 C--N 1.318 -0.467 0 C-N-CA 121.14 -0.552 . . . . 0.0 111.937 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.7 p -146.31 141.7 27.55 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-N 116.955 0.378 . . . . 0.0 111.941 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.622 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 5.3 tt -68.78 127.47 33.18 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.331 176.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -97.57 -31.47 12.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.613 178.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -156.77 140.07 15.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.617 0.246 . . . . 0.0 110.876 178.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.414 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -113.94 131.51 56.29 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.518 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 8.7 mp -93.19 175.94 6.59 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -178.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -76.7 -27.94 55.68 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.692 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -126.49 14.09 7.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.028 0.918 . . . . 0.0 110.698 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.518 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -143.23 91.2 2.25 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.111 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -103.61 152.63 21.53 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.721 -176.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' CYS . . . . . 0.445 ' HB2' HD12 ' A' ' 90' ' ' LEU . 67.8 m -134.91 156.19 49.4 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 121.295 0.569 . . . . 0.0 111.855 -177.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.622 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 19.5 pm0 -64.02 149.91 46.43 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.801 -1.091 . . . . 0.0 108.449 169.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.509 ' HA ' ' HB3' ' A' ' 90' ' ' LEU . 57.3 pttt -81.52 -31.69 32.68 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -173.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.0 t -155.69 148.82 24.55 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 119.387 -0.925 . . . . 0.0 112.451 177.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 26.8 m -134.27 143.02 39.3 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.15 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.275 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 12.2 t -128.18 128.95 45.72 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-N 114.482 -1.236 . . . . 0.0 107.912 175.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.9 tt -141.07 139.69 33.23 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 CA-C-O 121.221 0.534 . . . . 0.0 111.375 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 16.3 m -130.41 127.48 39.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -133.52 132.53 21.91 Favored Pre-proline 0 C--N 1.305 -1.365 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.447 ' HA ' HD23 ' A' ' 83' ' ' LEU . 50.8 Cg_exo -51.21 118.07 3.98 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 121.561 1.507 . . . . 0.0 110.956 178.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.458 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 9.4 t -77.52 -30.06 52.71 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.239 -176.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -88.06 -168.46 44.36 Favored Glycine 0 N--CA 1.437 -1.279 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -155.79 164.23 38.81 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-O 120.729 0.299 . . . . 0.0 110.275 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 79.0 mt -84.29 158.06 21.33 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 20.3 p -68.25 114.29 6.6 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.435 0.635 . . . . 0.0 111.812 -178.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -120.54 96.56 48.93 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.663 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.71 141.72 95.66 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.757 2.304 . . . . 0.0 112.782 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -87.14 -42.25 0.53 Allowed Pre-proline 0 C--N 1.306 -1.286 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.19 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo -88.27 104.17 0.48 Allowed 'Trans proline' 0 C--N 1.37 1.664 0 C-N-CA 121.948 1.765 . . . . 0.0 111.396 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -78.52 140.88 38.51 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.073 -179.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -71.55 175.76 5.31 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.74 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -56.26 -37.17 69.43 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.317 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.4 m 61.25 -166.86 0.2 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.754 177.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -84.94 111.84 20.04 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 58.6 pttt -72.88 -4.66 33.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.04 0.448 . . . . 0.0 111.437 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -102.42 25.39 9.06 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.536 178.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -60.53 -35.61 76.42 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.15 0.5 . . . . 0.0 110.515 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -124.58 140.09 53.27 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.715 177.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -75.52 122.28 23.64 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.13 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -130.94 159.35 22.98 Favored Glycine 0 N--CA 1.437 -1.281 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.709 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -98.28 99.79 11.03 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 120.791 0.329 . . . . 0.0 110.268 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 49.5 tptt -76.64 113.23 14.05 Favored 'General case' 0 N--CA 1.426 -1.652 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -66.69 140.16 57.88 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.163 -176.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 44.96 36.85 2.09 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.688 1.195 . . . . 0.0 113.303 177.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 94.3 mttt 62.72 -88.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.688 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 75.2 mtp -146.99 21.11 1.25 Allowed 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.006 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 47.1 tp 66.84 86.68 0.13 Allowed 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.954 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 C--N 1.31 -1.133 0 CA-C-N 114.779 -1.101 . . . . 0.0 109.394 179.102 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.377 0 N-CA-C 111.689 -0.564 . . . . 0.0 111.689 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -104.96 -15.82 15.02 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.877 0.37 . . . . 0.0 111.41 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -113.48 92.07 3.87 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.964 0.411 . . . . 0.0 112.059 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -111.91 -56.22 2.41 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -149.32 71.84 10.01 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.79 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.413 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 2.1 Cg_endo -86.81 -137.48 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.796 2.331 . . . . 0.0 111.247 -177.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.413 ' H ' ' HB2' ' A' ' 6' ' ' PRO . 36.0 tt0 61.76 78.63 0.28 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.838 -177.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -164.24 -74.44 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.023 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.6 tttt 67.52 135.83 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.452 0.701 . . . . 0.0 112.232 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.6 p -103.5 144.18 14.42 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.098 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.906 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 pttt -147.38 96.37 2.69 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.061 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -131.65 67.98 1.5 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.398 0.618 . . . . 0.0 111.38 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.8 m -126.51 25.26 6.54 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 122.121 0.962 . . . . 0.0 108.498 177.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -75.74 146.33 40.15 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 113.754 -1.566 . . . . 0.0 112.351 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.784 ' SG ' ' HA3' ' A' ' 41' ' ' GLY . 5.2 t 92.7 -77.32 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 124.846 1.258 . . . . 0.0 110.269 171.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -178.3 174.18 46.5 Favored Glycine 0 N--CA 1.435 -1.38 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -109.46 166.17 11.09 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.518 0.675 . . . . 0.0 111.243 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.422 ' HA ' ' O ' ' A' ' 38' ' ' THR . 98.6 m95 -65.08 128.98 38.05 Favored 'General case' 0 N--CA 1.418 -2.067 0 CA-C-N 114.462 -1.245 . . . . 0.0 111.413 174.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -87.66 137.96 31.88 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 176.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -110.27 124.02 50.87 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 121.324 0.583 . . . . 0.0 112.329 -174.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.0 m -107.13 168.51 9.16 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.21 -0.905 . . . . 0.0 108.961 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.6 m -96.51 152.9 3.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.569 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 79.3 m -66.91 129.85 41.24 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.788 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 17.1 m -109.29 111.1 60.14 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.799 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.06 156.83 63.96 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.404 2.07 . . . . 0.0 111.686 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.6 m -91.25 -25.81 19.31 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-O 121.247 0.546 . . . . 0.0 109.549 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -160.56 136.75 8.54 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.644 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -69.94 -26.96 73.69 Favored Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -80.99 54.24 2.16 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.4 m 59.41 88.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.114 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.519 ' H ' HD13 ' A' ' 55' ' ' ILE . . . -144.34 141.82 10.48 Favored Glycine 0 N--CA 1.437 -1.252 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.531 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.7 tp -57.04 152.15 13.73 Favored 'General case' 0 C--O 1.203 -1.392 0 C-N-CA 122.502 0.321 . . . . 0.0 111.38 -177.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.0 171.77 22.31 Favored Glycine 0 N--CA 1.438 -1.23 0 N-CA-C 110.57 -1.012 . . . . 0.0 110.57 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.4 p -135.68 154.18 51.37 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 117.441 0.62 . . . . 0.0 112.06 -178.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -137.09 142.2 42.35 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 175.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -130.25 130.87 45.14 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 120.757 0.313 . . . . 0.0 111.627 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.54 145.81 17.52 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.422 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 71.2 p -134.91 154.76 51.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 117.843 0.821 . . . . 0.0 111.115 -177.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -118.11 154.51 31.99 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.2 m -150.73 161.87 41.8 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.387 -175.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.784 ' HA3' ' SG ' ' A' ' 15' ' ' CYS . . . 166.16 -173.44 41.68 Favored Glycine 0 N--CA 1.434 -1.47 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.54 -32.72 64.36 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 117.593 0.696 . . . . 0.0 111.411 -178.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -105.52 0.97 27.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.961 0.41 . . . . 0.0 111.843 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 78.2 m -98.71 117.32 32.91 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 120.91 0.386 . . . . 0.0 111.858 -177.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.77 140.56 40.68 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.793 175.31 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 62.53 19.79 11.49 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.671 0.607 . . . . 0.0 111.466 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -84.11 77.89 9.86 Favored 'General case' 0 N--CA 1.437 -1.105 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 177.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 55.2 mtt -134.31 152.86 52.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.057 -175.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -148.54 131.45 16.15 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.374 178.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.2 m -117.1 138.02 51.91 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -131.62 152.24 50.98 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 120.729 0.299 . . . . 0.0 110.824 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -85.95 129.44 34.83 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 176.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 9.1 t -95.78 178.83 5.32 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -175.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -113.65 141.14 47.58 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.438 0.637 . . . . 0.0 111.284 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.519 HD13 ' H ' ' A' ' 31' ' ' GLY . 12.4 tt -123.59 120.29 26.93 Favored Pre-proline 0 C--N 1.299 -1.605 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.64 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 55' ' ' ILE . 12.4 Cg_exo -70.41 98.44 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.375 2.05 . . . . 0.0 111.822 178.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 54.1 t -80.85 114.03 19.46 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.924 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -84.67 129.21 34.86 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.942 0.401 . . . . 0.0 111.623 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 48.3 m95 53.61 68.07 0.9 Allowed 'General case' 0 C--O 1.239 0.522 0 CA-C-N 114.981 -1.009 . . . . 0.0 112.339 177.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -91.95 -11.83 35.06 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.628 0.727 . . . . 0.0 109.385 177.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -65.88 114.11 4.86 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.707 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -142.65 24.66 1.87 Allowed 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.13 -177.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 79.3 t80 75.95 -37.3 0.31 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.622 0.769 . . . . 0.0 112.335 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -158.24 132.12 3.03 Favored Glycine 0 C--N 1.29 -2.008 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.626 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.06 -75.99 0.59 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.622 0.248 . . . . 0.0 110.701 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -93.68 -21.58 19.27 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.161 0.505 . . . . 0.0 110.588 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 56.3 m -83.42 160.52 21.56 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.378 178.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -130.81 127.82 39.43 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.858 ' CE2' ' HB2' ' A' ' 90' ' ' LEU . 54.8 m-85 -109.27 128.47 55.1 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.611 -178.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -100.51 117.58 34.94 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 177.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.565 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 44.2 p90 -99.02 145.11 27.41 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-O 120.83 0.347 . . . . 0.0 111.158 -176.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -89.78 162.34 15.57 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 71.74 116.85 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.16 0.912 . . . . 0.0 110.661 -175.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -89.11 -3.12 58.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.757 0.789 . . . . 0.0 109.826 -177.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.92 140.13 11.54 Favored Glycine 0 N--CA 1.436 -1.336 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.943 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -107.98 141.23 39.95 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.626 ' HA ' ' HB3' ' A' ' 84' ' ' LYS . 48.9 t 79.53 102.24 0.07 Allowed 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 121.662 0.744 . . . . 0.0 110.777 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -83.73 111.85 19.54 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 114.874 -1.057 . . . . 0.0 108.51 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.552 ' H ' HD23 ' A' ' 79' ' ' LEU . 2.5 pt? -63.82 -31.81 73.12 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.612 -1.176 . . . . 0.0 113.254 -173.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -74.95 -28.7 60.69 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.438 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.626 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.7 p -105.19 -8.55 18.29 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 120.004 -0.678 . . . . 0.0 112.44 -175.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.32 25.08 12.33 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 123.466 0.706 . . . . 0.0 110.625 -175.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 81' ' ' THR . 44.9 mt -128.71 149.49 50.67 Favored 'General case' 0 C--O 1.202 -1.437 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.121 -177.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.626 ' HB3' ' HA ' ' A' ' 77' ' ' CYS . 8.3 ptmt -121.58 135.46 55.0 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 120.879 0.371 . . . . 0.0 110.246 177.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.3 m -137.95 138.3 38.82 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -177.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -140.33 136.42 33.19 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 120.814 0.34 . . . . 0.0 110.179 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.5 m -128.75 134.23 48.36 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.63 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.565 ' HA2' ' HA ' ' A' ' 71' ' ' PHE . . . -135.69 152.3 20.92 Favored Glycine 0 CA--C 1.495 -1.214 0 C-N-CA 120.466 -0.874 . . . . 0.0 111.784 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 20.1 p -141.04 146.42 37.18 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.24 0.543 . . . . 0.0 111.961 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.858 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.8 tm? -91.29 121.46 33.05 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.236 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -97.4 -12.39 22.81 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -174.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 92' ' ' ARG . 14.9 ttm180 -161.57 133.76 5.8 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.564 0.221 . . . . 0.0 110.496 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -113.6 148.6 35.91 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.448 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 9.8 mp -85.74 172.09 11.09 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 -178.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -78.46 -18.38 54.95 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.112 0.482 . . . . 0.0 110.404 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -119.63 37.6 4.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.698 0.761 . . . . 0.0 109.706 179.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.448 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -157.63 124.26 4.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.335 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -111.1 122.98 49.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.648 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' CYS . . . . . 0.455 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 74.7 m -145.68 148.3 32.9 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.956 -0.566 . . . . 0.0 112.177 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.74 152.54 45.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.267 178.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -73.52 -35.72 65.62 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.915 -175.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 9.3 t -156.26 148.91 23.8 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 118.877 -1.129 . . . . 0.0 113.449 179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.1 m -131.63 139.26 51.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 113.8 -1.546 . . . . 0.0 110.83 175.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 56.7 m -129.74 133.78 47.22 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.411 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.48 132.08 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 4.8 m -131.82 126.28 33.94 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -135.5 138.17 27.89 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -62.71 123.15 11.81 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 121.7 1.6 . . . . 0.0 110.252 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.417 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 13.4 t -83.16 178.37 8.14 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.763 0.316 . . . . 0.0 110.479 -176.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 92.03 -45.81 2.66 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -177.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -85.74 112.76 21.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.652 -0.274 . . . . 0.0 110.493 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 57.94 86.99 0.07 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.374 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 19.6 p -91.92 122.49 34.49 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.097 178.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -152.8 89.2 3.79 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-O 120.719 0.295 . . . . 0.0 110.956 -178.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -67.06 146.02 75.48 Favored 'Trans proline' 0 CA--C 1.514 -0.504 0 C-N-CA 122.699 2.266 . . . . 0.0 111.912 177.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.474 ' N ' ' HD3' ' A' ' 117' ' ' PRO . 40.4 ttmt -149.5 60.55 4.62 Favored Pre-proline 0 C--N 1.309 -1.178 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.452 174.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.474 ' HD3' ' N ' ' A' ' 116' ' ' LYS . 35.7 Cg_exo -61.7 89.73 0.1 Allowed 'Trans proline' 0 C--N 1.365 1.415 0 C-N-CA 122.366 2.044 . . . . 0.0 111.58 175.46 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -94.32 -29.7 14.9 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.06 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -69.93 100.84 1.64 Allowed 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.343 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.401 ' HG3' ' NZ ' ' A' ' 123' ' ' LYS . 6.9 pt-20 -97.24 130.8 44.41 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.769 -178.216 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 21.9 p -127.68 -165.42 1.48 Allowed 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.456 178.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 75.8 -1.72 2.92 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.401 ' NZ ' ' HG3' ' A' ' 120' ' ' GLU . 14.5 pttm -83.71 -0.58 51.41 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.072 0.463 . . . . 0.0 111.096 178.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -112.54 135.77 52.86 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -73.71 -24.47 59.93 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.116 0.484 . . . . 0.0 110.016 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -102.73 135.27 44.69 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.646 -0.707 . . . . 0.0 109.917 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -143.26 144.08 31.99 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.894 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 148.54 88.0 0.07 OUTLIER Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 -177.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -95.48 26.18 4.04 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -81.27 106.13 13.01 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.744 -176.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -129.65 95.94 4.12 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 176.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -107.41 -179.67 3.99 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.631 -176.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -69.12 133.95 48.69 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.402 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 93.7 mmm -93.42 102.55 14.79 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 177.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 8.5 mp 70.36 135.31 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.655 0.782 . . . . 0.0 111.688 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 . . . . . 0 C--N 1.312 -1.04 0 CA-C-O 118.662 -0.685 . . . . 0.0 110.199 -179.184 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.526 0 N-CA-C 111.822 -0.511 . . . . 0.0 111.822 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -77.85 110.97 13.21 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -64.12 108.12 1.46 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.722 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.429 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 0.5 OUTLIER -93.43 35.96 1.09 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.348 -179.111 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.6 mttt 63.36 77.23 0.33 Allowed Pre-proline 0 N--CA 1.469 0.477 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.841 -178.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -92.06 -85.44 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.601 0 C-N-CA 122.739 2.293 . . . . 0.0 113.01 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -88.67 155.6 19.5 Favored 'General case' 0 C--N 1.287 -2.135 0 CA-C-N 114.832 -1.076 . . . . 0.0 112.036 -178.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.1 tptp 74.44 -48.56 0.65 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.544 1.138 . . . . 0.0 112.056 178.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -110.71 104.07 12.69 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-O 121.223 0.535 . . . . 0.0 110.174 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.7 p -89.15 152.96 3.26 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.395 -177.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -80.99 137.29 36.08 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.086 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.3 tttm 57.4 94.18 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.579 0.752 . . . . 0.0 112.151 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.7 p -77.64 -10.51 59.55 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.854 0.835 . . . . 0.0 110.184 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -87.82 149.07 24.37 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 114.035 -1.439 . . . . 0.0 109.772 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.4 m 70.5 81.32 0.16 Allowed 'General case' 0 C--O 1.233 0.217 0 O-C-N 123.695 0.622 . . . . 0.0 110.487 -177.221 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.13 174.69 40.25 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.193 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 19' ' ' GLN . 42.3 mt-10 -75.83 171.3 14.62 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 122.46 0.304 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.677 ' HA ' ' O ' ' A' ' 38' ' ' THR . 88.5 m95 -45.92 119.51 2.27 Favored 'General case' 0 N--CA 1.442 -0.839 0 O-C-N 123.894 0.746 . . . . 0.0 112.698 -177.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.47 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 68.3 mt-30 -113.15 115.56 28.46 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -100.45 138.69 37.17 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.225 0.536 . . . . 0.0 111.481 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.0 t -101.33 172.44 6.99 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.416 -0.811 . . . . 0.0 108.895 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 29.1 m -91.95 148.56 4.56 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 62.3 m -63.6 128.41 35.7 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.829 -175.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 p -106.23 114.79 61.99 Favored Pre-proline 0 N--CA 1.44 -0.93 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -61.29 148.09 93.83 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.599 2.2 . . . . 0.0 112.972 -176.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.3 m -87.64 -28.53 21.81 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-O 121.678 0.752 . . . . 0.0 109.195 178.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 46.3 t -149.95 134.58 17.56 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.888 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.07 -30.57 69.78 Favored Glycine 0 CA--C 1.504 -0.616 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.338 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.557 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 6.5 m-20 -68.17 -41.47 81.44 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.3 m 166.02 92.15 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.583 1.153 . . . . 0.0 110.847 178.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -141.31 120.09 1.62 Allowed Glycine 0 CA--C 1.498 -0.976 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.895 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.452 ' H ' HD22 ' A' ' 32' ' ' LEU . 3.2 mm? -53.68 114.13 1.43 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.998 0.428 . . . . 0.0 111.671 -176.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.96 175.77 53.96 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.886 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 p -136.42 154.66 50.73 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -133.71 146.04 50.44 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.001 176.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -120.82 131.56 54.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.514 0.197 . . . . 0.0 110.649 -178.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.47 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -128.21 151.37 18.76 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 178.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.677 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 58.8 p -130.0 149.37 51.75 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 117.395 0.598 . . . . 0.0 111.25 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.502 ' HB2' ' CE2' ' A' ' 18' ' ' TRP . 53.2 ttp180 -132.24 161.4 33.53 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.496 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 9.0 t -113.75 162.7 15.97 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-O 121.756 0.788 . . . . 0.0 111.087 178.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -111.82 -174.29 19.67 Favored Glycine 0 C--N 1.294 -1.788 0 CA-C-N 114.042 -1.435 . . . . 0.0 110.058 177.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.94 -30.51 69.83 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 117.562 0.681 . . . . 0.0 110.099 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -101.93 5.44 40.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.412 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.429 ' HA ' ' OG1' ' A' ' 40' ' ' THR . 52.9 t 60.51 70.85 0.6 Allowed 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.991 -175.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -90.89 -18.41 24.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.055 -178.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 39' ' ' ARG . 15.3 mm100 66.74 100.56 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.893 0.854 . . . . 0.0 112.829 178.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 m -101.72 143.32 31.8 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 114.74 -1.118 . . . . 0.0 108.542 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -120.85 152.59 38.21 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.18 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -141.89 136.07 30.12 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.9 m -129.77 136.72 49.96 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -133.64 151.1 51.6 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-O 121.053 0.454 . . . . 0.0 111.294 -176.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.463 ' HD2' ' N ' ' A' ' 52' ' ' ARG . 0.2 OUTLIER -101.91 128.1 48.45 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.44 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 31.7 m -92.65 170.58 9.61 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 -174.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.7 mttm -113.79 139.91 48.74 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.371 0.605 . . . . 0.0 112.125 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.9 mt -112.37 131.54 22.55 Favored Pre-proline 0 C--N 1.305 -1.369 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.631 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.449 ' O ' ' HB2' ' A' ' 57' ' ' CYS . 9.5 Cg_endo -52.45 -54.5 5.08 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.426 2.75 . . . . 0.0 113.486 -178.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 56' ' ' PRO . 41.9 m 73.43 -51.18 0.7 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.085 0.554 . . . . 0.0 112.357 -178.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -75.95 132.43 40.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.176 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 91.1 m95 54.72 42.87 30.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.401 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.557 ' HE3' ' O ' ' A' ' 29' ' ' ASP . 22.3 pttm -86.04 6.0 30.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.018 0.437 . . . . 0.0 111.234 178.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -81.6 131.31 35.27 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.031 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -164.24 123.19 1.9 Allowed 'General case' 0 N--CA 1.439 -1.018 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -178.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -72.54 129.97 39.54 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.316 -178.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -136.56 172.71 22.39 Favored Glycine 0 N--CA 1.442 -0.949 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -132.66 1.19 3.66 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -82.92 -20.93 34.41 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.245 0.545 . . . . 0.0 110.455 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.404 ' HB2' HD21 ' A' ' 90' ' ' LEU . 6.5 p -99.67 -176.48 3.28 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 175.125 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -129.85 142.44 50.67 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.491 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.429 ' CE2' HD23 ' A' ' 90' ' ' LEU . 29.6 m-85 -117.44 152.49 34.89 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.01 -178.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -124.96 118.77 26.98 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.406 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 28.3 p90 -95.79 135.57 37.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.201 0.524 . . . . 0.0 111.135 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.482 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 0.2 OUTLIER -110.5 162.17 14.96 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.808 -178.577 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -124.55 87.27 2.69 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.152 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 47.9 t-105 -87.24 -24.35 24.42 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.417 0.627 . . . . 0.0 109.526 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -161.62 118.19 0.81 Allowed Glycine 0 N--CA 1.439 -1.154 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.764 178.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -96.85 116.23 28.8 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.491 ' SG ' ' HG3' ' A' ' 84' ' ' LYS . 55.7 m 59.99 102.06 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.917 0.76 . . . . 0.0 112.022 -176.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -69.81 111.94 5.9 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 177.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 20.2 mt -69.29 -28.93 66.71 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.695 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -65.27 -38.59 90.77 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.219 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 65.7 p -106.72 -14.59 14.97 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.278 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 69.48 39.89 1.53 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.921 -1.036 . . . . 0.0 108.727 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.464 ' HA ' ' H ' ' A' ' 109' ' ' CYS . 90.3 mt -125.34 168.01 14.13 Favored 'General case' 0 C--O 1.204 -1.321 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.859 -178.034 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.491 ' HG3' ' SG ' ' A' ' 77' ' ' CYS . 36.1 tttm -121.15 137.44 54.67 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -177.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 14.2 t -137.12 146.7 45.37 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.495 0.664 . . . . 0.0 110.878 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -137.56 135.54 36.77 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.39 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.482 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 33.4 m -107.44 141.97 38.0 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.406 ' HA2' ' HA ' ' A' ' 71' ' ' PHE . . . -136.47 152.57 21.25 Favored Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 178.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.494 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 19.0 m -141.08 147.94 39.37 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.063 0.459 . . . . 0.0 111.28 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.587 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.1 tm? -72.73 119.03 16.4 Favored 'General case' 0 N--CA 1.408 -2.571 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.388 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -105.39 -25.69 12.27 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 120.429 -0.509 . . . . 0.0 111.114 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -155.85 133.61 11.15 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.042 0.448 . . . . 0.0 111.004 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -135.47 150.72 49.89 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.788 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.4 mp -84.49 158.99 20.82 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 177.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -68.29 -27.08 66.0 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.757 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -100.37 38.85 1.43 Allowed 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.509 0.671 . . . . 0.0 109.304 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.83 99.26 1.39 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.626 -177.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -84.23 133.19 34.59 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.974 179.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 74.8 m -145.94 140.71 27.13 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.811 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.587 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -67.54 153.87 42.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.707 178.647 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.61 ' HD3' ' H ' ' A' ' 101' ' ' LYS . 0.3 OUTLIER -73.93 -26.52 60.56 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.316 -174.671 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.494 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 8.8 t -149.22 149.82 31.59 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-O 122.016 0.912 . . . . 0.0 113.043 179.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 29.6 m -129.17 144.04 39.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 113.857 -1.52 . . . . 0.0 110.749 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 34.6 m -129.51 131.8 46.72 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.839 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.09 136.39 47.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.807 0.337 . . . . 0.0 110.358 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.3 p -123.18 137.0 55.0 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.549 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -134.46 128.78 19.32 Favored Pre-proline 0 C--O 1.21 -1.019 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.553 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -50.29 126.21 16.95 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 122.129 1.886 . . . . 0.0 112.394 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.464 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 43.1 t -97.71 107.13 19.56 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.569 -177.023 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -142.23 -77.81 0.04 OUTLIER Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.072 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -125.63 168.38 13.8 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.823 -0.222 . . . . 0.0 110.881 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.3 tp 60.6 74.84 0.43 Allowed 'General case' 0 C--O 1.238 0.454 0 O-C-N 123.975 0.797 . . . . 0.0 110.572 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 6.8 p -104.49 142.79 33.98 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.206 -178.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.414 ' HD3' ' C ' ' A' ' 114' ' ' LYS . 9.5 tmtt? -125.62 92.42 46.62 Favored Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -76.76 -161.54 0.14 Allowed 'Trans proline' 0 CA--C 1.531 0.373 0 C-N-CA 123.108 2.539 . . . . 0.0 113.089 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.648 ' H ' ' CD ' ' A' ' 117' ' ' PRO . 64.3 tttp -160.03 -40.52 0.0 OUTLIER Pre-proline 0 CA--C 1.55 0.978 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.653 -179.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.648 ' CD ' ' H ' ' A' ' 116' ' ' LYS . 14.7 Cg_exo -70.9 128.69 15.31 Favored 'Trans proline' 0 C--N 1.378 2.092 0 C-N-CA 121.62 1.547 . . . . 0.0 111.017 179.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -77.99 -22.06 49.95 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.412 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -101.71 154.05 19.24 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.338 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.477 ' OE1' ' HE2' ' A' ' 122' ' ' LYS . 29.3 mm-40 -70.12 105.45 2.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.317 0.579 . . . . 0.0 110.479 178.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 20.2 m -99.23 34.05 2.26 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.052 -177.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.477 ' HE2' ' OE1' ' A' ' 120' ' ' GLU . 67.6 mttm -72.63 96.53 2.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.111 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -72.96 109.77 6.76 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.741 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -85.2 139.2 31.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.374 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -82.79 101.17 10.76 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -125.16 167.61 14.58 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.409 -177.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -81.99 94.78 7.23 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.215 0.531 . . . . 0.0 110.24 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -138.77 61.84 0.57 Allowed Glycine 0 N--CA 1.44 -1.056 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.27 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -145.97 119.24 8.93 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.717 0.294 . . . . 0.0 110.77 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -70.51 133.77 47.1 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -71.98 119.31 15.98 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -70.3 97.54 1.26 Allowed 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.16 0.505 . . . . 0.0 112.116 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -93.0 142.72 26.98 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.794 177.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 91.4 mmm -69.46 158.14 35.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.993 0.425 . . . . 0.0 111.667 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 81.9 mt -81.56 170.89 15.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.36 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.226 178.913 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.063 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -75.95 93.81 3.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.62 0.248 . . . . 0.0 110.454 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.2 pttp -171.13 170.01 6.28 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.249 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -94.56 178.85 5.47 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.725 176.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm 54.5 88.53 0.12 Allowed Pre-proline 0 CA--C 1.533 0.324 0 C-N-CA 123.283 0.633 . . . . 0.0 112.458 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.91 -91.14 0.0 OUTLIER 'Trans proline' 0 CA--C 1.514 -0.504 0 C-N-CA 122.502 2.135 . . . . 0.0 111.781 177.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 67.17 163.04 0.19 Allowed 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.991 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -138.96 -167.22 2.17 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm 68.53 -177.45 0.21 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.174 0.511 . . . . 0.0 111.208 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.2 p -140.47 150.34 21.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.359 177.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -94.22 179.61 5.25 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.014 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -76.54 -29.67 56.8 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 175.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.1 p -99.07 97.82 8.91 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.443 174.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.477 ' O ' ' HB3' ' A' ' 15' ' ' CYS . 7.8 p-10 -114.57 165.33 12.89 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.916 -175.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.477 ' HB3' ' O ' ' A' ' 14' ' ' ASP . 49.4 t 95.15 -40.35 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.03 1.332 . . . . 0.0 111.816 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.487 ' O ' ' HD2' ' A' ' 39' ' ' ARG . . . 179.06 128.88 1.23 Allowed Glycine 0 N--CA 1.438 -1.2 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -102.91 164.62 11.51 Favored 'General case' 0 CA--C 1.494 -1.198 0 CA-C-N 117.341 0.57 . . . . 0.0 110.552 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.576 ' HA ' ' O ' ' A' ' 38' ' ' THR . 74.6 m95 -52.57 118.14 3.4 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.2 mm-40 -119.33 112.74 19.81 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 172.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -97.35 145.08 26.48 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.042 -177.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.8 m -93.77 171.68 8.72 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.955 -1.02 . . . . 0.0 108.583 177.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.496 ' HA ' ' NE2' ' A' ' 131' ' ' GLN . 35.3 m -93.53 155.71 3.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.253 -176.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 38.0 t -69.03 99.98 1.16 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 -176.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.2 p -94.48 132.96 27.75 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.652 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.0 110.94 0.75 Allowed 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.641 2.227 . . . . 0.0 111.728 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 97.0 m -65.95 -23.14 66.54 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.146 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.449 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 12.2 t -133.14 176.56 8.4 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.927 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.47 80.26 0.01 OUTLIER Glycine 0 C--N 1.334 0.454 0 O-C-N 124.006 0.816 . . . . 0.0 113.658 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.9 t70 76.67 -38.99 0.33 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.506 1.122 . . . . 0.0 111.939 175.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 47.4 t -123.66 109.61 13.94 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.934 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.449 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -172.94 154.99 22.0 Favored Glycine 0 CA--C 1.491 -1.42 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 -178.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.5 tp -64.13 108.99 1.69 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 118.224 1.012 . . . . 0.0 109.01 178.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.26 175.31 25.12 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.113 -0.948 . . . . 0.0 114.825 -173.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.84 153.66 50.72 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.694 -0.753 . . . . 0.0 111.395 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -144.15 138.35 28.09 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -115.57 132.01 56.76 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.797 -0.183 . . . . 0.0 111.333 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -131.24 136.22 8.69 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 177.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.576 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 6.9 p -123.89 148.24 46.99 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 121.194 -0.202 . . . . 0.0 111.076 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.556 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 11.2 tpt85 -157.01 160.1 38.67 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.334 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.58 146.17 26.38 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.513 175.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -98.72 -150.35 25.78 Favored Glycine 0 C--O 1.217 -0.967 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.84 -36.56 49.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 118.085 0.942 . . . . 0.0 109.681 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 20.6 mm-40 -85.47 -0.52 55.15 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.216 174.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 5.2 m 40.05 60.57 1.7 Allowed 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.749 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 36.2 mmtm -118.28 141.8 48.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.028 0.442 . . . . 0.0 112.038 -178.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.445 ' O ' ' HG3' ' A' ' 48' ' ' MET . 47.9 mt-30 45.22 -108.34 0.15 Allowed 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.082 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.441 ' O ' ' HB3' ' A' ' 39' ' ' ARG . 0.8 OUTLIER 48.32 27.74 1.43 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 178.693 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.445 ' HG3' ' O ' ' A' ' 46' ' ' GLN . 86.9 mtp -113.96 146.12 40.57 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -147.6 137.37 22.76 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.469 0.652 . . . . 0.0 111.78 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.1 p -114.4 138.46 50.54 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 174.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -134.1 151.53 51.42 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-O 121.875 0.845 . . . . 0.0 112.098 -174.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -85.67 139.05 31.7 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 113.677 -1.601 . . . . 0.0 109.144 172.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 52.9 t -117.98 159.24 23.5 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -173.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.5 tttm -114.27 124.88 53.11 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 52.9 mt -101.94 128.47 28.61 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.413 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.78 48.66 2.25 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 123.131 2.554 . . . . 0.0 113.107 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 26.8 p -104.03 177.53 4.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.712 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -77.87 147.22 35.22 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.227 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 79.5 m95 60.52 100.47 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.872 0.733 . . . . 0.0 111.504 -178.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -128.12 149.62 50.34 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.496 -177.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -129.41 170.23 13.93 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.587 176.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -159.7 39.76 0.2 Allowed 'General case' 0 N--CA 1.434 -1.258 0 CA-C-O 121.315 0.578 . . . . 0.0 109.567 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -96.16 179.79 4.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.84 -178.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -123.47 -162.91 11.62 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.833 -0.699 . . . . 0.0 111.992 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.62 -62.87 1.43 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.878 0.37 . . . . 0.0 110.731 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -86.28 -5.15 59.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.131 0.491 . . . . 0.0 110.505 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 62.8 m -65.73 141.01 58.49 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.686 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -116.8 125.39 51.53 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.467 ' HE2' ' HB2' ' A' ' 90' ' ' LEU . 36.5 m-85 -126.41 146.85 49.91 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -173.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.44 ' HB2' ' HE3' ' A' ' 91' ' ' LYS . 64.2 tt0 -126.49 115.73 20.01 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 106.189 -1.782 . . . . 0.0 106.189 170.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -101.29 156.42 17.46 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -173.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 35.3 tt0 -78.66 144.76 35.07 Favored 'General case' 0 N--CA 1.4 -2.971 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 172.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' A' ' 72' ' ' GLN . . . 166.5 120.91 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.288 0.367 . . . . 0.0 110.45 -173.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' TRP . . . . . 0.513 ' CZ3' ' HB2' ' A' ' 76' ' ' GLU . 1.1 p-90 -92.16 -8.66 44.95 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.239 0.542 . . . . 0.0 110.379 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 107.87 -39.32 2.94 Favored Glycine 0 CA--C 1.507 -0.437 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.04 175.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.513 ' HB2' ' CZ3' ' A' ' 74' ' ' TRP . 36.9 mt-10 -95.65 142.6 27.77 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 114.978 -0.611 . . . . 0.0 110.34 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 31.0 p -78.31 171.14 15.51 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 176.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -94.06 121.53 35.64 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.491 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 20.8 mt -72.83 -30.15 63.8 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.14 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -67.45 -33.36 74.98 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 121.321 0.581 . . . . 0.0 110.125 -177.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.723 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 76.8 p -104.27 -9.25 18.72 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.643 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.19 24.64 11.62 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.126 0.97 . . . . 0.0 111.475 -177.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.723 ' HG ' ' O ' ' A' ' 81' ' ' THR . 65.6 mt -131.39 165.08 24.28 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-O 120.961 0.41 . . . . 0.0 110.41 -172.156 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -119.83 132.71 55.66 Favored 'General case' 0 N--CA 1.414 -2.253 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.2 p -135.14 142.0 46.09 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.027 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.6 mtm180 -139.94 128.49 22.93 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.2 m -99.95 145.34 27.96 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -145.31 149.37 21.49 Favored Glycine 0 N--CA 1.434 -1.478 0 C-N-CA 118.879 -1.629 . . . . 0.0 112.664 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 101' ' ' LYS . 29.1 m -132.12 149.34 52.43 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.103 -0.549 . . . . 0.0 111.015 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.595 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.1 tm? -75.48 122.04 23.25 Favored 'General case' 0 N--CA 1.414 -2.268 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.44 ' HE3' ' HB2' ' A' ' 70' ' ' GLN . 11.4 ptpt -101.26 -15.23 17.36 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -177.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -162.55 130.82 3.97 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.439 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -138.22 144.19 40.5 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.4 mp -91.28 170.54 9.9 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.442 178.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -69.54 -13.42 62.33 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.278 0.561 . . . . 0.0 110.996 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -107.15 29.92 6.67 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.16 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.55 115.95 3.79 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.445 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -87.69 123.46 32.55 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 80.4 m -134.83 139.76 45.32 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.541 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.595 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 1.2 pm0 -70.03 145.18 51.93 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.193 176.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 89' ' ' SER . 36.4 ttpt -72.25 -42.47 65.62 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.225 -176.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.2 t -152.44 148.19 27.15 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 118.512 -1.275 . . . . 0.0 113.019 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.3 m -131.88 149.35 32.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.88 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 11.3 t -114.08 139.61 49.16 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 114.238 -1.346 . . . . 0.0 109.12 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 13.3 mt -131.03 138.31 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.118 0 CA-C-O 120.917 0.389 . . . . 0.0 111.015 -173.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.7 t -130.09 128.9 42.8 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.03 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -136.09 129.32 17.95 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.294 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.84 113.65 3.07 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 121.086 1.19 . . . . 0.0 110.61 175.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 50.7 t -81.3 67.41 7.23 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -175.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 55.1 -129.06 45.21 Favored Glycine 0 C--O 1.239 0.425 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.708 177.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 42.8 mttp 57.18 46.07 19.5 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 121.714 0.769 . . . . 0.0 110.589 179.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 48.3 tp 57.36 86.55 0.07 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 113.706 -1.588 . . . . 0.0 111.199 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 16.4 p -77.04 115.3 16.7 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.785 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -139.47 82.58 18.4 Favored Pre-proline 0 C--N 1.312 -1.031 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.62 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -71.15 -75.31 0.01 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.903 2.402 . . . . 0.0 112.741 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 23.8 pttm 30.06 63.33 0.9 Allowed Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.323 1.049 . . . . 0.0 113.372 -173.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.64 68.13 0.25 Allowed 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 123.248 2.632 . . . . 0.0 113.94 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 72.81 -37.87 0.4 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.001 0.92 . . . . 0.0 113.257 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 64.63 67.77 0.55 Allowed 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.454 0.645 . . . . 0.0 110.979 -178.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -83.92 -56.15 3.85 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.298 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 61.1 p -156.93 155.14 30.86 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.353 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -70.88 99.01 1.67 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 9.6 pttm 64.43 169.11 0.18 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.491 1.116 . . . . 0.0 111.515 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -91.57 163.42 14.14 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.398 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -86.97 3.12 47.1 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.257 0.551 . . . . 0.0 110.543 179.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -89.91 -171.49 3.17 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.057 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 69.16 9.51 7.4 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.153 0.581 . . . . 0.0 112.208 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -86.6 68.73 3.23 Favored Glycine 0 N--CA 1.438 -1.174 0 C-N-CA 120.853 -0.689 . . . . 0.0 111.891 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -73.63 109.77 7.4 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -78.81 42.11 0.44 Allowed 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.653 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.496 ' NE2' ' HA ' ' A' ' 22' ' ' VAL . 88.0 mm-40 62.53 -167.89 0.2 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.061 0.544 . . . . 0.0 111.446 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -87.8 121.81 30.68 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.884 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -68.05 107.17 2.61 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.082 -179.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 66.1 mtt -74.92 123.06 24.4 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.777 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.8 mt 68.02 160.58 0.17 Allowed 'General case' 0 C--O 1.239 0.549 0 O-C-N 123.887 0.742 . . . . 0.0 111.793 -179.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 36.5 t70 . . . . . 0 C--N 1.316 -0.882 0 CA-C-O 118.802 -0.618 . . . . 0.0 109.88 -179.531 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.075 0 N-CA-C 111.591 -0.604 . . . . 0.0 111.591 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 58.6 tttp 65.1 99.23 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.173 0.589 . . . . 0.0 111.655 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -83.54 134.37 34.83 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 177.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -61.51 -41.73 97.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.556 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.7 tttm 64.39 94.77 0.05 OUTLIER Pre-proline 0 CA--C 1.536 0.44 0 O-C-N 123.844 0.715 . . . . 0.0 111.222 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.22 -94.34 0.01 OUTLIER 'Trans proline' 0 CA--C 1.517 -0.332 0 C-N-CA 122.673 2.249 . . . . 0.0 112.569 -179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 58.06 85.26 0.09 Allowed 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.338 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -113.97 144.13 43.58 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.435 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -62.1 120.49 10.97 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-O 121.207 0.527 . . . . 0.0 111.635 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.9 p -107.8 157.83 7.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.048 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -93.4 -166.75 1.58 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.671 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -65.65 96.51 0.27 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.176 0.512 . . . . 0.0 110.452 177.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.7 p -86.7 142.36 28.24 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.921 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 15' ' ' CYS . 38.3 t70 -90.5 115.93 28.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.034 0.445 . . . . 0.0 111.61 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ASP . 34.4 t 171.47 -69.03 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.592 -1.185 . . . . 0.0 108.987 178.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -154.98 155.14 26.02 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 17' ' ' GLU . 1.8 pm0 -86.91 166.92 14.76 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -50.63 122.04 6.65 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.988 -1.006 . . . . 0.0 112.389 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -103.51 136.73 42.7 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 176.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -120.83 130.89 54.15 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.634 0.73 . . . . 0.0 112.425 -175.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.2 t -94.49 171.82 8.57 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 114.502 -1.226 . . . . 0.0 107.845 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.8 m -92.36 142.67 12.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.042 -178.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.8 t -66.36 132.43 48.32 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.362 -176.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.4 t -93.11 116.35 66.36 Favored Pre-proline 0 C--N 1.311 -1.102 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.513 ' O ' ' HB ' ' A' ' 26' ' ' THR . 19.2 Cg_endo -57.62 -23.96 59.89 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.169 2.579 . . . . 0.0 113.138 -175.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.513 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 55.5 m 83.01 -41.92 0.1 Allowed 'General case' 0 C--O 1.234 0.238 0 C-N-CA 123.209 0.604 . . . . 0.0 111.091 177.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 t 70.41 -146.56 0.08 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.736 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.403 ' O ' ' HB3' ' A' ' 29' ' ' ASP . . . 64.46 51.5 51.73 Favored Glycine 0 CA--C 1.498 -1.029 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -176.064 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.403 ' HB3' ' O ' ' A' ' 28' ' ' GLY . 20.8 t70 72.92 -57.72 0.62 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.624 0.77 . . . . 0.0 111.146 -178.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 68.1 m -155.21 96.95 1.87 Allowed 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 123.597 0.759 . . . . 0.0 109.043 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.408 ' H ' HD13 ' A' ' 55' ' ' ILE . . . -120.84 145.85 17.39 Favored Glycine 0 N--CA 1.431 -1.682 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.887 -179.109 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.7 tp -72.39 109.45 6.1 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.71 155.08 52.76 Favored Glycine 0 N--CA 1.438 -1.181 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.14 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.0 p -135.43 152.27 51.22 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.228 0.537 . . . . 0.0 111.306 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -133.49 149.31 51.73 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -130.37 131.11 45.16 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 120.723 0.297 . . . . 0.0 110.917 -178.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -123.07 144.72 15.86 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 109.771 -1.331 . . . . 0.0 109.771 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 28.2 p -134.91 153.94 51.87 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 117.429 0.615 . . . . 0.0 111.65 -177.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.444 ' HG2' ' N ' ' A' ' 40' ' ' THR . 22.6 ttt180 -149.53 161.35 42.3 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.511 ' HB ' ' HA ' ' A' ' 44' ' ' CYS . 1.3 p -104.95 154.42 20.12 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 177.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -87.35 -166.53 42.61 Favored Glycine 0 CA--C 1.507 -0.423 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.79 -23.33 58.49 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 118.46 1.13 . . . . 0.0 108.911 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.428 ' HG3' ' HG2' ' A' ' 45' ' ' LYS . 6.7 pt-20 -94.86 7.79 44.81 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.495 -1.23 . . . . 0.0 109.587 176.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.511 ' HA ' ' HB ' ' A' ' 40' ' ' THR . 93.7 m 65.08 30.32 11.67 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.996 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 40' ' ' THR . 32.8 mmtp -80.05 -178.34 6.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.668 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -96.2 109.21 21.71 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.976 0.417 . . . . 0.0 111.904 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -109.43 126.38 53.41 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 175.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 27.3 ttt -137.02 153.25 50.69 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -173.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -144.8 135.15 24.27 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.242 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.5 m -116.98 139.04 51.14 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -134.72 152.13 51.52 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.797 0.332 . . . . 0.0 110.6 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.444 ' N ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -105.41 130.91 53.4 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.156 179.249 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 58.1 m -87.91 -168.52 2.24 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 39.3 tttp -124.51 131.47 53.49 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.408 HD13 ' H ' ' A' ' 31' ' ' GLY . 20.1 tt -106.45 118.14 55.36 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 121.014 0.435 . . . . 0.0 110.544 -179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.28 -29.12 3.27 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.579 2.186 . . . . 0.0 112.91 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 62.1 m 66.52 12.66 8.87 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 122.849 0.459 . . . . 0.0 112.05 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -84.44 145.68 28.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.819 0.343 . . . . 0.0 110.402 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -77.2 99.95 5.62 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.212 0.529 . . . . 0.0 110.85 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -91.27 101.79 14.49 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.258 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -88.25 -96.63 0.09 Allowed 'General case' 0 CA--C 1.498 -1.02 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.249 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -172.56 124.67 0.48 Allowed 'General case' 0 N--CA 1.421 -1.924 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 -178.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -94.56 103.05 15.0 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.297 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 107.07 71.22 0.76 Allowed Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.153 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -129.65 -62.03 0.98 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.056 0.455 . . . . 0.0 110.382 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -83.69 -15.14 49.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.589 0.709 . . . . 0.0 109.525 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 9.9 p -153.81 -166.14 2.31 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 114.981 -1.009 . . . . 0.0 108.469 -177.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -132.01 147.36 52.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.481 ' CE2' HD23 ' A' ' 90' ' ' LEU . 48.5 m-85 -118.35 151.55 37.52 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-O 121.18 0.514 . . . . 0.0 111.899 -177.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.462 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 48.8 tp60 -114.76 117.66 31.39 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.033 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -96.58 141.55 29.71 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -119.03 162.39 18.64 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.099 0.476 . . . . 0.0 109.851 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.3 156.76 44.4 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.156 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -103.99 -11.53 17.36 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 165.12 -147.45 12.53 Favored Glycine 0 N--CA 1.428 -1.839 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -117.52 113.87 22.62 Favored 'General case' 0 N--CA 1.427 -1.589 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.869 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 14.9 t 60.77 118.25 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 O-C-N 124.049 0.843 . . . . 0.0 111.633 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -68.82 109.97 4.13 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.9 mt -69.33 -22.29 63.77 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.691 -174.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -66.69 -39.77 88.25 Favored 'General case' 0 N--CA 1.425 -1.675 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.203 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.8 p -107.82 -14.71 14.72 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 69.54 27.17 4.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 122.136 0.97 . . . . 0.0 108.998 -178.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.471 HD22 ' HA ' ' A' ' 108' ' ' PRO . 22.6 mt -127.71 167.44 16.45 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-N 114.218 -1.356 . . . . 0.0 107.978 -178.67 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.545 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 27.7 ttpt -121.84 136.48 54.93 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.762 -177.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.6 m -120.1 145.33 47.0 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 115.175 -0.921 . . . . 0.0 111.565 -175.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -130.32 129.34 43.07 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 176.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.07 138.57 48.55 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.7 152.58 23.14 Favored Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.066 -178.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 23.0 t -145.66 146.02 31.14 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.026 0.441 . . . . 0.0 110.703 -179.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.0 tm? -68.11 123.06 19.61 Favored 'General case' 0 N--CA 1.406 -2.632 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.492 176.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.462 ' HD3' ' HB2' ' A' ' 70' ' ' GLN . 59.6 mtmt -85.75 -48.18 9.05 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 120.905 0.383 . . . . 0.0 110.715 -178.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -161.67 144.44 12.03 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.047 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -132.99 151.78 52.03 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.429 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tp -83.18 169.85 15.35 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -65.5 -27.4 68.45 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.586 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -105.13 45.74 0.95 Allowed 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.555 0.693 . . . . 0.0 109.41 177.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -150.34 115.16 5.28 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.059 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -103.37 117.24 34.03 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.563 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' CYS . . . . . 0.453 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 83.8 m -141.05 145.9 36.48 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.068 0.461 . . . . 0.0 111.582 -178.195 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.61 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 20.1 pm0 -66.76 150.08 49.63 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.377 175.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -76.72 -36.53 57.11 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.198 -173.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.45 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 5.4 t -152.57 149.53 28.58 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 119.296 -0.961 . . . . 0.0 113.378 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 17.0 m -136.39 140.64 43.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.94 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 11.0 t -128.85 136.69 50.81 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.507 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 12.9 tt -140.33 140.69 34.29 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 121.159 0.504 . . . . 0.0 111.249 -178.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 18.6 m -120.43 128.46 53.21 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.018 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -131.32 115.78 16.3 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.394 -179.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.471 ' HA ' HD22 ' A' ' 83' ' ' LEU . 77.0 Cg_exo -51.26 127.63 22.73 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.524 2.149 . . . . 0.0 112.078 178.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.545 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 86.0 m -65.68 -50.22 65.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.806 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -175.42 131.65 1.98 Allowed Glycine 0 N--CA 1.438 -1.224 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.666 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -81.96 145.73 30.13 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.5 mp -53.99 126.85 24.07 Favored 'General case' 0 C--O 1.239 0.547 0 O-C-N 123.494 0.496 . . . . 0.0 111.563 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 7.4 p -79.82 169.91 17.26 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.48 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 61.33 71.61 0.77 Allowed Pre-proline 0 N--CA 1.467 0.396 0 O-C-N 123.408 0.442 . . . . 0.0 110.203 -177.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -57.36 -76.74 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.946 2.431 . . . . 0.0 113.063 -178.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp 41.09 62.99 6.25 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.269 0.628 . . . . 0.0 112.043 -176.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -52.17 141.05 49.83 Favored 'Trans proline' 0 C--N 1.362 1.269 0 C-N-CA 122.543 2.162 . . . . 0.0 111.264 176.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -62.67 118.55 7.8 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.325 0.583 . . . . 0.0 110.92 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -159.93 142.01 13.15 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.071 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -60.98 122.13 14.15 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 177.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 39.6 m -77.56 35.04 0.18 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.14 0.495 . . . . 0.0 111.901 -176.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -124.62 162.12 24.79 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -77.92 90.2 4.13 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.136 0.493 . . . . 0.0 111.303 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -90.94 154.24 19.6 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.931 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt 66.88 99.15 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 O-C-N 123.76 0.663 . . . . 0.0 111.135 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -82.88 179.67 7.7 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.363 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -71.42 96.13 1.44 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.988 0.423 . . . . 0.0 111.672 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -85.14 45.67 3.55 Favored Glycine 0 N--CA 1.45 -0.408 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 176.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -142.58 156.03 45.06 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -177.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -157.29 92.82 1.27 Allowed 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 120.96 0.409 . . . . 0.0 110.142 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -78.93 105.29 10.16 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.175 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -60.8 -35.85 77.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.491 -177.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -147.06 159.82 43.13 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -75.61 127.0 32.11 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 64.1 tp 73.99 130.33 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 O-C-N 124.122 0.889 . . . . 0.0 111.14 -177.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 33.9 t70 . . . . . 0 C--O 1.255 1.362 0 C-N-CA 123.625 0.77 . . . . 0.0 111.317 -179.462 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.101 0 N-CA-C 111.928 -0.469 . . . . 0.0 111.928 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.41 ' NZ ' ' HB2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -141.83 17.49 2.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.708 0.254 . . . . 0.0 111.361 -179.608 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -81.66 156.11 25.26 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.824 0.345 . . . . 0.0 110.949 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -77.59 91.34 3.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.375 -177.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -149.32 93.52 4.09 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-O 121.013 0.435 . . . . 0.0 110.619 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -99.1 -136.66 0.01 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 123.5 2.8 . . . . 0.0 110.886 178.252 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -110.11 108.66 18.92 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.327 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -76.85 -21.67 54.66 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.2 tttt 64.08 121.55 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 114.524 -1.216 . . . . 0.0 113.257 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.3 p -85.26 151.96 3.68 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.772 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -85.78 43.89 1.07 Allowed 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.431 0.634 . . . . 0.0 111.265 -176.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -131.2 149.31 52.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.143 178.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 p -80.05 92.11 5.57 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.035 0.445 . . . . 0.0 110.24 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.85 106.77 17.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.135 -177.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.49 ' HA ' ' HB ' ' A' ' 40' ' ' THR . 1.3 m 59.96 91.9 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.586 176.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -134.48 177.58 19.1 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.495 -0.859 . . . . 0.0 113.067 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.57 ' CD ' ' H ' ' A' ' 17' ' ' GLU . 1.4 pm0 -85.45 170.66 12.46 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 123.791 0.836 . . . . 0.0 111.438 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.541 ' HA ' ' O ' ' A' ' 38' ' ' THR . 66.1 m95 -46.77 119.86 2.69 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.692 0.758 . . . . 0.0 112.888 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 93.5 mt-30 -116.1 115.12 25.5 Favored 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 175.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -101.13 146.55 27.33 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -175.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.0 t -91.98 174.98 7.04 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 114.53 -1.213 . . . . 0.0 109.334 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.9 m -93.13 153.46 3.33 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.325 -175.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.437 ' SG ' ' HD3' ' A' ' 35' ' ' ARG . 34.0 m -84.23 112.04 19.92 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.785 -176.029 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.48 ' O ' ' HA3' ' A' ' 33' ' ' GLY . 6.9 m -106.86 102.76 44.15 Favored Pre-proline 0 N--CA 1.435 -1.201 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 174.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.544 ' O ' ' HB ' ' A' ' 26' ' ' THR . 26.3 Cg_endo -62.18 -16.55 51.43 Favored 'Trans proline' 0 C--O 1.218 -0.484 0 C-N-CA 122.839 2.359 . . . . 0.0 112.553 -176.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.544 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 51.9 m 81.62 -14.53 0.79 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 122.544 1.164 . . . . 0.0 108.875 177.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.503 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 16.7 t -142.37 -145.46 0.17 Allowed 'General case' 0 N--CA 1.411 -2.414 0 CA-C-N 113.767 -1.561 . . . . 0.0 109.113 -178.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -151.93 -42.25 0.02 OUTLIER Glycine 0 CA--C 1.482 -2.023 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -102.98 66.54 0.92 Allowed 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.38 0.61 . . . . 0.0 110.797 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.2 m 75.29 76.43 0.1 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.463 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.503 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -127.89 154.94 19.98 Favored Glycine 0 N--CA 1.44 -1.04 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 177.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.469 HD21 HH11 ' A' ' 52' ' ' ARG . 55.7 tp -83.76 125.42 31.89 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.739 0.269 . . . . 0.0 110.893 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.48 ' HA3' ' O ' ' A' ' 24' ' ' VAL . . . -139.17 164.74 25.83 Favored Glycine 0 CA--C 1.505 -0.564 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 -177.062 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 6.8 m -145.69 154.92 42.62 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -174.445 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.437 ' HD3' ' SG ' ' A' ' 23' ' ' CYS . 23.5 ptt180 -134.9 154.32 51.72 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.759 176.112 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.444 ' HG2' HG22 ' A' ' 50' ' ' THR . 25.3 mt-10 -115.96 131.72 56.86 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.148 -177.05 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -122.46 151.07 16.89 Favored Glycine 0 CA--C 1.52 0.357 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.541 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 14.2 p -134.32 155.03 50.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.429 0.614 . . . . 0.0 111.471 -177.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.539 ' HG2' ' N ' ' A' ' 40' ' ' THR . 17.5 ttt180 -151.49 160.47 43.69 Favored 'General case' 0 C--O 1.217 -0.609 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.427 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.596 HG22 ' HA ' ' A' ' 44' ' ' CYS . 0.2 OUTLIER -133.71 155.34 49.92 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 174.908 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -106.39 -152.11 19.35 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 111.095 -0.802 . . . . 0.0 111.095 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.58 -33.63 53.86 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 117.062 0.431 . . . . 0.0 111.649 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -84.94 1.68 46.25 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -177.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.596 ' HA ' HG22 ' A' ' 40' ' ' THR . 66.4 m 57.78 32.87 22.52 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.873 0.368 . . . . 0.0 111.422 -178.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -68.36 -23.54 64.7 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.312 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 72.25 105.46 0.07 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.635 0.731 . . . . 0.0 112.278 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 m -105.15 145.11 31.02 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.269 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 26.0 ttt -139.54 148.25 42.34 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.555 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -143.35 136.34 27.78 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.444 HG22 ' HG2' ' A' ' 36' ' ' GLU . 13.0 p -116.62 135.9 53.41 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 55.7 tp60 -137.86 138.24 38.9 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 120.364 -0.535 . . . . 0.0 111.386 -177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.469 HH11 HD21 ' A' ' 32' ' ' LEU . 39.6 mtt180 -87.37 131.5 34.26 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 85.4 m -82.36 160.64 22.77 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -113.69 135.38 54.0 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-O 121.259 0.552 . . . . 0.0 112.113 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 31' ' ' GLY . 4.0 mp -111.16 126.22 29.08 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.751 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -70.08 103.18 1.18 Allowed 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.487 2.125 . . . . 0.0 111.349 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 4.6 t -99.55 176.13 5.59 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.213 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -71.92 145.35 48.53 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.862 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.0 p90 -84.25 165.37 18.41 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.807 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -129.21 173.05 10.84 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.899 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.01 127.78 33.82 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.434 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -123.97 35.42 4.84 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.387 0.613 . . . . 0.0 109.813 -176.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -71.41 -17.19 62.41 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.378 -178.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.45 102.53 2.6 Favored Glycine 0 C--N 1.302 -1.314 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.243 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.5 -32.88 74.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.625 0.25 . . . . 0.0 111.625 -178.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -84.76 -13.4 51.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.968 0.413 . . . . 0.0 111.027 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 82.0 m -81.91 158.86 23.8 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.704 ' O ' ' HA ' ' A' ' 90' ' ' LEU . 47.6 mtpt -128.19 127.68 43.37 Favored 'General case' 0 CA--C 1.498 -1.025 0 C-N-CA 119.631 -0.828 . . . . 0.0 110.896 -176.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 100' ' ' GLN . 79.0 m-85 -124.8 129.33 50.24 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.894 -175.034 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -112.07 129.75 56.11 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -94.14 135.7 35.24 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.979 0.419 . . . . 0.0 110.924 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.19 162.97 13.58 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.916 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.65 92.27 3.22 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.713 -177.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 43.0 p-90 -92.45 -18.07 23.71 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.525 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -167.27 110.77 0.41 Allowed Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.991 -0.843 . . . . 0.0 110.991 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -95.53 115.84 28.0 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-O 120.792 0.329 . . . . 0.0 111.774 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.622 ' H ' ' HG3' ' A' ' 84' ' ' LYS . 13.5 t 60.76 107.72 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.744 -1.116 . . . . 0.0 112.428 175.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.55 ' OD2' HG22 ' A' ' 81' ' ' THR . 27.3 t70 -82.16 131.16 35.24 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.789 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.8 mt -72.39 -32.41 66.37 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.559 -176.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -69.13 -42.42 76.04 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.288 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.568 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 10.0 t -105.99 -1.61 23.79 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -175.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 55.06 32.47 18.32 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -178.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 81' ' ' THR . 24.0 mt -127.1 164.33 21.82 Favored 'General case' 0 CA--C 1.497 -1.081 0 O-C-N 121.845 -0.535 . . . . 0.0 110.143 -178.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.622 ' HG3' ' H ' ' A' ' 77' ' ' CYS . 77.5 tttt -120.64 136.68 54.76 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -177.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 4.2 m -119.35 144.24 46.97 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.567 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -139.48 141.19 37.4 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.089 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 14.2 m -120.93 145.5 47.63 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.091 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -144.55 157.16 27.14 Favored Glycine 0 N--CA 1.443 -0.849 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.9 m -145.61 149.64 34.89 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.62 0.21 . . . . 0.0 111.206 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.768 HD12 ' HA ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -69.46 129.97 41.2 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.003 0.43 . . . . 0.0 110.219 177.595 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -92.65 -32.72 14.65 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 120.906 0.384 . . . . 0.0 110.91 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.94 143.93 31.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -134.65 145.46 48.6 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.71 0.291 . . . . 0.0 110.822 -176.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.7 mp -91.4 174.73 7.22 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.233 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -88.95 -17.25 29.88 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.105 0.478 . . . . 0.0 110.833 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -101.86 28.03 6.03 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.274 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -164.01 117.79 1.47 Allowed 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.983 -176.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -82.03 111.27 18.03 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 174.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 80.4 m -94.3 165.21 12.7 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.37 0.605 . . . . 0.0 112.262 -175.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.497 ' O ' ' HB3' ' A' ' 90' ' ' LEU . 88.4 mt-30 -87.04 124.62 33.41 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.251 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.768 ' HA ' HD12 ' A' ' 90' ' ' LEU . 20.1 pttm -74.79 -31.96 61.88 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.412 -178.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.9 t -158.88 149.22 19.63 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-O 121.463 0.649 . . . . 0.0 111.389 175.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 13.7 m -141.5 139.47 32.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.063 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.5 m -129.04 131.67 47.38 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.108 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 22.4 pt -135.47 145.63 31.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 CA-C-O 120.625 0.25 . . . . 0.0 110.453 -177.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 84' ' ' LYS . 6.5 p -122.55 134.38 54.54 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.872 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -126.03 132.32 24.27 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.888 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.42 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 30.8 Cg_endo -64.03 124.47 13.56 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.049 1.833 . . . . 0.0 112.233 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 94.9 m -73.12 -17.85 61.35 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.235 0.541 . . . . 0.0 109.822 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -145.96 160.16 28.08 Favored Glycine 0 N--CA 1.433 -1.536 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.7 mttm 65.08 83.21 0.17 Allowed 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.646 0.736 . . . . 0.0 111.017 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 87.7 mt -81.18 97.49 7.62 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.59 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 10.9 p -94.05 154.55 17.57 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.316 -179.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 57.4 pttt 40.88 75.83 0.56 Allowed Pre-proline 0 N--CA 1.484 1.233 0 C-N-CA 124.169 0.987 . . . . 0.0 113.287 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -68.29 146.12 68.23 Favored 'Trans proline' 0 C--O 1.238 0.52 0 C-N-CA 122.666 2.244 . . . . 0.0 112.433 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -69.44 -47.5 26.52 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.069 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -79.46 88.6 1.43 Allowed 'Trans proline' 0 C--N 1.369 1.634 0 C-N-CA 121.947 1.765 . . . . 0.0 111.46 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -88.81 2.88 52.83 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.917 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 66.07 114.67 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.871 0.732 . . . . 0.0 111.75 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -76.71 84.94 3.34 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 121.136 0.493 . . . . 0.0 110.058 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 27.1 p -80.58 -6.84 58.87 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.312 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -61.01 121.24 11.93 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.464 178.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -65.23 -27.44 68.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.975 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 83.2 tttt 63.1 47.52 4.15 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.829 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt 61.09 50.18 5.15 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.786 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 97.3 mttt 66.26 -168.62 0.2 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.654 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -62.28 150.58 38.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.958 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -87.95 -61.6 1.49 Allowed Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.87 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -128.18 152.49 47.98 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.986 0.422 . . . . 0.0 110.825 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -110.27 88.08 2.67 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.411 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 44.7 tt0 -121.46 129.42 52.96 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.866 -174.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 131' ' ' GLN . 10.2 pt-20 49.09 15.46 0.11 Allowed 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 125.431 1.493 . . . . 0.0 115.003 175.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.7 mttm 62.04 -178.32 0.13 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.282 0.563 . . . . 0.0 111.219 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 65.9 mtt -91.1 101.8 14.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.945 0.402 . . . . 0.0 109.95 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 94.4 mt -97.4 -176.31 3.47 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.375 -179.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.416 -0.802 . . . . 0.0 109.582 178.327 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.246 0 N-CA-C 111.766 -0.534 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -89.49 4.75 48.18 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -177.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -65.43 -27.87 68.83 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.547 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 60.96 -172.22 0.14 Allowed 'General case' 0 C--O 1.239 0.505 0 O-C-N 123.426 0.454 . . . . 0.0 110.59 -176.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.1 mttm 48.79 79.89 0.32 Allowed Pre-proline 0 N--CA 1.471 0.582 0 C-N-CA 123.61 0.764 . . . . 0.0 112.718 175.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -93.16 -140.15 0.02 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 122.875 2.383 . . . . 0.0 110.536 178.573 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -107.41 39.08 1.97 Allowed 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.299 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 mttp 54.5 26.18 6.93 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.563 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -65.9 126.81 29.7 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.436 -178.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.9 p -93.96 165.61 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.799 177.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -84.84 164.03 18.69 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.24 -179.5 3.39 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.231 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.1 m -52.45 95.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -176.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -115.12 135.14 54.52 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.014 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.3 p -109.6 19.58 19.07 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -178.53 131.29 1.7 Allowed Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.034 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -107.83 164.55 12.15 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -56.98 123.55 15.54 Favored 'General case' 0 N--CA 1.427 -1.592 0 O-C-N 123.528 0.518 . . . . 0.0 111.109 173.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.571 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 74.3 mt-30 -115.95 115.45 26.19 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -104.26 143.61 32.73 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 t -104.38 171.59 7.25 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.87 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.8 m -94.61 154.82 3.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.6 t -56.16 114.15 1.84 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.325 -178.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 10.5 m -109.99 120.81 43.63 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.989 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.97 129.58 19.87 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 122.786 2.324 . . . . 0.0 113.731 -177.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.485 ' HB ' ' O ' ' A' ' 32' ' ' LEU . 94.9 m -77.75 -22.51 50.17 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.227 176.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.585 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 17.9 t -159.71 116.91 2.62 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.65 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.9 -32.73 80.79 Favored Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.746 -0.661 . . . . 0.0 113.088 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -76.38 52.68 0.79 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.566 0.222 . . . . 0.0 111.371 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.491 ' HA ' HD13 ' A' ' 55' ' ' ILE . 42.5 t 65.95 80.98 0.21 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.141 179.15 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.585 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -148.87 157.11 27.14 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.3 -0.952 . . . . 0.0 114.191 -177.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.485 ' O ' ' HB ' ' A' ' 26' ' ' THR . 4.3 mm? -49.26 158.42 0.38 Allowed 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 124.465 1.106 . . . . 0.0 112.459 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.1 176.71 19.85 Favored Glycine 0 N--CA 1.434 -1.496 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -178.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.4 p -140.35 156.19 46.51 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 118.24 1.02 . . . . 0.0 113.049 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 70.9 mtt-85 -135.62 138.47 42.94 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.749 -1.114 . . . . 0.0 108.542 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -124.85 131.31 53.45 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 120.858 0.361 . . . . 0.0 111.583 -177.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.571 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -133.42 137.33 9.27 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.6 p -132.04 152.8 50.96 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 117.439 0.619 . . . . 0.0 111.083 -177.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.41 ' HG2' ' N ' ' A' ' 40' ' ' THR . 68.7 ttt180 -155.17 160.77 41.16 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.41 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 6.2 p -117.88 161.85 19.08 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.042 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.42 ' H ' ' N ' ' A' ' 45' ' ' LYS . . . -81.11 -173.03 47.15 Favored Glycine 0 C--N 1.322 -0.248 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.222 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.79 -33.47 72.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.983 0.42 . . . . 0.0 110.983 -178.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -97.7 18.12 16.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.497 0.665 . . . . 0.0 109.414 176.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 72.4 m 69.06 60.04 0.34 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.954 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.469 ' HG3' ' H ' ' A' ' 46' ' ' GLN . 14.4 tptm -77.6 -145.87 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.814 176.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.469 ' H ' ' HG3' ' A' ' 45' ' ' LYS . 52.2 tt0 -150.1 116.09 5.64 Favored 'General case' 0 N--CA 1.412 -2.342 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 -178.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.0 m -133.47 122.18 23.28 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 57.0 mtm -129.0 134.97 48.36 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.912 0.387 . . . . 0.0 111.114 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -132.25 130.33 40.79 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.541 177.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 p -130.8 131.3 44.58 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 176.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -124.93 141.97 51.77 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 121.105 0.478 . . . . 0.0 110.231 -176.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -85.45 110.72 19.37 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 122.451 1.12 . . . . 0.0 112.232 -177.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.2 t -68.66 147.23 52.18 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 113.063 -1.88 . . . . 0.0 109.867 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.0 tttm -114.07 142.14 46.57 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-O 120.753 0.311 . . . . 0.0 110.552 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.491 HD13 ' HA ' ' A' ' 30' ' ' CYS . 17.9 tt -97.91 130.89 27.76 Favored Pre-proline 0 C--N 1.308 -1.197 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -51.0 -52.65 8.64 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.974 2.449 . . . . 0.0 112.242 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 6.3 t 70.73 177.08 0.27 Allowed 'General case' 0 CA--C 1.536 0.44 0 O-C-N 123.764 0.665 . . . . 0.0 110.886 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -84.27 138.29 33.01 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.445 -178.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.1 m95 46.04 65.87 1.07 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.95 0.781 . . . . 0.0 111.383 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.3 pttt -90.8 142.86 27.32 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.953 -177.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -103.96 135.52 45.33 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 172.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -153.26 15.4 0.53 Allowed 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 121.748 0.785 . . . . 0.0 109.742 -174.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -98.59 93.19 5.99 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.517 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -83.37 -15.38 71.66 Favored Glycine 0 C--N 1.314 -0.664 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.634 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 62.55 15.69 8.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.047 0.539 . . . . 0.0 111.719 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -84.25 -5.63 59.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.363 0.601 . . . . 0.0 110.293 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 50.0 m -136.52 -160.68 1.08 Allowed 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -127.11 137.05 52.92 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.047 0.385 . . . . 0.0 110.134 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -123.26 150.24 43.75 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.995 -178.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.9 tm0? -125.51 125.43 43.25 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -94.18 131.43 39.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.199 0.523 . . . . 0.0 112.141 -176.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -97.25 163.79 12.76 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.84 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -126.66 79.32 1.86 Allowed 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.109 -178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 42.2 t-105 -82.32 -26.31 33.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.238 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -143.78 157.14 26.95 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.574 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -96.32 147.92 23.3 Favored 'General case' 0 N--CA 1.437 -1.113 0 C-N-CA 123.167 0.587 . . . . 0.0 110.15 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 40.5 t -30.63 137.38 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 O-C-N 124.203 0.939 . . . . 0.0 111.428 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -77.85 122.04 24.92 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 121.516 0.674 . . . . 0.0 109.841 -176.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.8 mt -70.7 -33.12 70.55 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 114.609 -1.178 . . . . 0.0 112.091 -173.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -71.67 -37.49 70.76 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.496 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.513 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 68.1 p -104.32 -8.01 19.57 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -172.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 57.27 34.5 24.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.275 0.56 . . . . 0.0 110.528 -175.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 81' ' ' THR . 44.1 mt -126.98 147.3 50.12 Favored 'General case' 0 CA--C 1.496 -1.11 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.094 -178.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.752 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 81.4 tttt -124.77 137.26 54.33 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.703 -178.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 52.3 m -119.12 143.76 47.0 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 -134.73 140.55 46.03 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.0 m -109.81 143.72 39.26 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -136.39 167.28 24.52 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 120.462 -0.875 . . . . 0.0 111.393 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.8 p -135.22 144.28 46.83 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 120.626 0.25 . . . . 0.0 110.7 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.599 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 2.9 tm? -70.76 122.87 20.66 Favored 'General case' 0 N--CA 1.409 -2.492 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -97.35 -37.54 9.99 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.957 0.408 . . . . 0.0 110.853 -177.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -155.64 135.06 12.4 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.234 178.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -126.18 144.78 50.63 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 42.9 mt -87.24 174.39 8.62 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.394 0.616 . . . . 0.0 111.535 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -73.64 -26.7 60.89 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.48 -178.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -105.05 35.94 2.64 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.613 0.72 . . . . 0.0 109.495 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -154.11 134.57 13.47 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.921 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -112.31 122.46 47.79 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 70.7 m -139.72 141.31 36.92 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.205 0.526 . . . . 0.0 111.599 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.599 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 3.0 pm0 -68.72 154.27 42.26 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.81 176.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.4 pttm -74.07 -26.55 60.45 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.555 -175.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.5 t -140.63 150.95 44.2 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.324 -0.55 . . . . 0.0 111.665 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 15.8 m -138.87 149.48 23.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.24 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 97.2 m -129.24 136.61 50.33 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.42 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tt -140.7 141.31 32.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 120.84 0.352 . . . . 0.0 110.614 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 57.6 m -121.16 134.8 55.23 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -134.27 133.94 22.24 Favored Pre-proline 0 C--N 1.313 -0.983 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.429 -178.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.43 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 32.7 Cg_exo -58.12 131.03 40.93 Favored 'Trans proline' 0 C--O 1.244 0.777 0 C-N-CA 121.924 1.75 . . . . 0.0 111.504 175.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.752 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 69.8 m -81.77 173.55 12.18 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.325 0.583 . . . . 0.0 111.576 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 168.18 -147.9 12.03 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -87.69 77.47 8.66 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.669 0.747 . . . . 0.0 110.635 178.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -131.98 166.58 21.36 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.186 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.471 ' O ' ' HD3' ' A' ' 115' ' ' PRO . 13.5 p -82.39 -178.35 7.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.3 177.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -114.48 86.32 12.24 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-O 120.725 0.297 . . . . 0.0 110.775 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.471 ' HD3' ' O ' ' A' ' 113' ' ' THR . 33.7 Cg_exo -63.82 136.56 53.89 Favored 'Trans proline' 0 C--O 1.24 0.615 0 C-N-CA 122.754 2.302 . . . . 0.0 113.271 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.543 ' N ' ' HD3' ' A' ' 117' ' ' PRO . 19.2 pttp -155.49 53.8 0.88 Allowed Pre-proline 0 C--N 1.306 -1.313 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.233 175.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.543 ' HD3' ' N ' ' A' ' 116' ' ' LYS . 42.0 Cg_exo -56.89 102.3 0.11 Allowed 'Trans proline' 0 C--N 1.372 1.776 0 C-N-CA 122.731 2.288 . . . . 0.0 113.366 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 68.97 127.77 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 177.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -135.64 115.92 13.5 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.548 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 123' ' ' LYS . 29.7 mt-10 -67.64 108.18 2.81 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.846 0.355 . . . . 0.0 110.819 -178.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 12.0 m -96.87 -24.55 15.82 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.074 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -92.47 -28.4 16.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.952 -179.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.485 ' HB2' ' HB3' ' A' ' 120' ' ' GLU . 40.9 mmtm -85.83 88.2 7.52 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.176 0.512 . . . . 0.0 110.211 177.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -82.83 -42.38 17.91 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.362 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 54.3 tptt 60.84 -78.4 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.803 0.841 . . . . 0.0 112.003 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 57.4 tttp 62.87 -79.43 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.885 0.874 . . . . 0.0 110.519 -176.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 66.18 168.7 0.22 Allowed 'General case' 0 C--O 1.237 0.441 0 C-N-CA 123.926 0.89 . . . . 0.0 112.658 176.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -167.76 -96.27 0.11 Allowed Glycine 0 N--CA 1.433 -1.532 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 178.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 58.8 mttp 50.07 78.03 0.11 Allowed 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.076 0.55 . . . . 0.0 112.342 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -69.93 87.95 0.56 Allowed 'General case' 0 N--CA 1.434 -1.273 0 CA-C-O 121.158 0.504 . . . . 0.0 109.753 177.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -55.8 -64.16 0.94 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.806 -178.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -157.07 131.25 8.42 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.473 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp -153.03 72.2 0.94 Allowed 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 28.0 ttt -80.27 128.8 33.96 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.553 -177.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 50.1 tp -140.06 102.66 4.44 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 C--N 1.311 -1.102 0 CA-C-O 118.287 -0.863 . . . . 0.0 111.354 -175.883 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.947 0 N-CA-C 111.459 -0.657 . . . . 0.0 111.459 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -113.92 -178.68 3.43 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.697 0.284 . . . . 0.0 110.51 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 4' ' ' GLU . 20.9 pttp -149.7 19.13 0.91 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.911 -176.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 3' ' ' LYS . 39.4 tt0 71.28 132.14 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -172.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 66.1 tttp 62.28 81.41 0.23 Allowed Pre-proline 0 C--O 1.238 0.46 0 CA-C-O 121.218 0.532 . . . . 0.0 109.66 -176.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.421 ' HG2' ' H ' ' A' ' 7' ' ' GLU . 59.8 Cg_endo -73.78 -88.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.512 -0.616 0 C-N-CA 122.731 2.287 . . . . 0.0 113.034 -178.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.421 ' H ' ' HG2' ' A' ' 6' ' ' PRO . 39.5 mt-10 60.42 68.58 0.75 Allowed 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.09 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -143.06 118.13 10.07 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.23 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -82.92 130.19 35.11 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.397 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 p -119.88 142.22 36.41 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.394 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.742 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.0 mtpt -127.89 153.01 47.14 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.653 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -88.42 100.84 13.34 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.8 m -150.66 -159.81 1.08 Allowed 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.548 -177.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -76.1 165.57 24.73 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.2 m 57.71 87.34 0.07 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.172 0.511 . . . . 0.0 110.907 -176.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -147.06 179.02 24.31 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.878 -177.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -76.2 169.66 17.79 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 122.93 0.492 . . . . 0.0 111.253 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.522 ' HA ' ' O ' ' A' ' 38' ' ' THR . 81.6 m95 -48.57 118.93 2.75 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.417 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.453 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 6.8 pt20 -120.14 115.44 23.66 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 89.7 m95 -100.8 146.41 27.32 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.803 -175.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 m -94.53 171.8 8.58 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 114.79 -1.095 . . . . 0.0 108.998 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.5 m -91.93 154.79 3.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -177.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.8 t -74.45 116.47 15.16 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.805 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.0 t -111.44 117.87 48.39 Favored Pre-proline 0 N--CA 1.434 -1.246 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 179.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.32 143.66 75.26 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.533 2.155 . . . . 0.0 112.373 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.436 ' HB ' ' O ' ' A' ' 32' ' ' LEU . 23.7 m -90.3 -23.8 21.06 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.354 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.4 t -134.62 173.63 11.45 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.074 179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.94 74.57 0.25 Allowed Glycine 0 N--CA 1.448 -0.565 0 O-C-N 123.683 0.614 . . . . 0.0 113.617 -177.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.7 t70 68.93 23.87 6.56 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-O 121.9 0.857 . . . . 0.0 110.826 174.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.502 ' HA ' ' HB2' ' A' ' 57' ' ' CYS . 9.0 t -150.92 10.35 0.61 Allowed 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.619 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.482 ' O ' HG13 ' A' ' 55' ' ' ILE . . . -126.51 126.1 5.62 Favored Glycine 0 CA--C 1.494 -1.229 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.539 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 53' ' ' CYS . 1.2 mp -51.64 152.4 2.81 Favored 'General case' 0 C--O 1.207 -1.158 0 O-C-N 124.176 0.574 . . . . 0.0 111.483 -179.028 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.07 -175.19 14.79 Favored Glycine 0 CA--C 1.496 -1.154 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 -173.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.2 p -136.8 154.14 50.62 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 117.816 0.808 . . . . 0.0 112.207 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -126.23 137.63 53.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 175.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -113.9 131.41 56.3 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.569 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.453 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -137.7 141.7 12.51 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.522 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 22.8 p -123.79 154.78 39.06 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.954 0.377 . . . . 0.0 110.658 -179.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.522 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 9.4 tpt180 -145.18 159.95 42.21 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.403 ' OG1' ' HA ' ' A' ' 44' ' ' CYS . 11.1 t -115.84 162.22 17.63 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-O 122.173 0.987 . . . . 0.0 112.225 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.41 -164.15 11.23 Favored Glycine 0 C--N 1.286 -2.24 0 CA-C-N 113.432 -1.713 . . . . 0.0 108.839 175.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.17 -25.97 66.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 118.254 1.027 . . . . 0.0 111.872 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -99.73 -11.34 20.94 Favored 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 120.182 -0.607 . . . . 0.0 111.364 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.403 ' HA ' ' OG1' ' A' ' 40' ' ' THR . 93.8 m 68.29 152.17 0.09 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptp 63.25 10.8 4.9 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.832 175.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -103.57 18.12 22.57 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.42 ' HB ' ' O ' ' A' ' 39' ' ' ARG . 11.9 m -143.62 110.44 5.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.549 0.69 . . . . 0.0 112.01 178.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 24.2 ttt -146.23 135.11 22.46 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.045 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -143.05 142.76 31.64 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.12 0.486 . . . . 0.0 111.397 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.1 m -118.4 136.58 53.68 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.08 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -128.73 141.19 51.4 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 110.264 -0.272 . . . . 0.0 110.264 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 84.1 mtt180 -86.91 139.49 30.58 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.441 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 1.5 p -99.96 -170.18 1.85 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -113.49 138.42 50.15 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.655 0.264 . . . . 0.0 110.75 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 31' ' ' GLY . 22.0 mm -126.69 111.15 22.63 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.273 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.76 122.92 9.59 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.569 2.179 . . . . 0.0 111.411 177.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.502 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 42.6 t -124.34 157.08 35.86 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.663 0.268 . . . . 0.0 110.986 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -67.28 146.76 53.81 Favored 'General case' 0 C--O 1.244 0.783 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.245 177.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -59.71 153.4 20.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.262 0.553 . . . . 0.0 112.05 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -92.37 -164.66 1.21 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.549 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.415 ' N ' ' HD2' ' A' ' 61' ' ' LYS . 9.8 mptt -84.4 141.99 30.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.796 -178.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -144.26 100.45 3.55 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -109.65 18.15 20.57 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.11 0.481 . . . . 0.0 111.262 -177.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 139.89 171.95 12.56 Favored Glycine 0 N--CA 1.445 -0.727 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.457 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.06 -56.89 2.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.017 0.436 . . . . 0.0 110.596 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -89.17 -19.72 25.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.879 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 99.0 m -80.72 116.52 20.77 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.539 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -112.98 130.33 56.17 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.696 ' CE1' HD23 ' A' ' 90' ' ' LEU . 4.6 m-85 -106.58 152.36 23.82 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.374 -177.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.447 ' O ' ' HA2' ' A' ' 88' ' ' GLY . 6.4 tp-100 -103.34 117.05 33.61 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 174.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -94.52 118.74 32.14 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -175.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -122.34 162.97 20.55 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.373 177.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.52 141.63 28.47 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-O 120.972 0.415 . . . . 0.0 111.037 -176.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 40.6 t-105 -97.65 -5.3 35.67 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 148.85 -170.57 29.25 Favored Glycine 0 N--CA 1.427 -1.94 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.873 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -95.68 148.48 22.5 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 124.04 0.936 . . . . 0.0 109.09 179.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 13.8 m -22.98 125.18 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.358 0 O-C-N 124.225 0.953 . . . . 0.0 112.447 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -80.33 120.46 24.41 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.1 mt -70.22 -28.33 65.18 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.304 -0.862 . . . . 0.0 112.302 -174.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -70.7 -37.38 73.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.029 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.611 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.5 p -105.37 -9.41 17.59 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -174.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.98 25.72 14.16 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.422 0.689 . . . . 0.0 110.972 -175.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 81' ' ' THR . 13.9 mt -126.86 162.41 25.95 Favored 'General case' 0 CA--C 1.5 -0.968 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.49 -177.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.623 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 34.9 ttpt -118.93 147.84 43.59 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.1 m -119.27 142.48 48.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.841 0.353 . . . . 0.0 110.479 -176.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.0 tpt180 -135.22 141.03 45.73 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -178.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.7 m -118.43 144.69 45.78 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.486 -178.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.447 ' HA2' ' O ' ' A' ' 70' ' ' GLN . . . -136.29 150.28 20.4 Favored Glycine 0 N--CA 1.435 -1.379 0 C-N-CA 120.195 -1.002 . . . . 0.0 111.938 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 25.8 m -127.36 134.29 49.97 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 120.981 0.419 . . . . 0.0 111.903 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.696 HD23 ' CE1' ' A' ' 69' ' ' TYR . 2.8 tm? -74.4 127.49 33.16 Favored 'General case' 0 N--CA 1.427 -1.62 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.235 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -86.77 -50.75 6.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.567 -177.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -144.08 142.02 30.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.83 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.526 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -135.18 140.02 45.02 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.7 mp -89.12 175.92 7.18 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 120.915 0.388 . . . . 0.0 110.582 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -83.23 0.52 45.16 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.909 0.385 . . . . 0.0 111.578 -176.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -101.19 15.14 29.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.162 0.506 . . . . 0.0 110.339 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -173.9 123.64 0.34 Allowed 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.04 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -93.58 110.14 21.75 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.331 0.586 . . . . 0.0 109.654 177.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 75.7 m -109.91 133.05 53.59 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.114 -177.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -66.96 150.81 48.71 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.01 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -74.82 -29.63 61.13 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.939 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.7 t -146.05 150.06 35.27 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.766 0.793 . . . . 0.0 112.263 178.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 28.7 m -135.49 146.87 29.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.316 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 95.8 m -128.43 127.68 43.0 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 13.5 tt -136.02 148.62 27.65 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 CA-C-O 120.818 0.342 . . . . 0.0 110.611 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 84' ' ' LYS . 54.6 m -130.3 135.68 48.34 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.097 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -133.26 148.59 69.68 Favored Pre-proline 0 C--N 1.319 -0.745 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.876 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.488 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 34.4 Cg_exo -59.63 131.98 43.16 Favored 'Trans proline' 0 CA--C 1.516 -0.408 0 C-N-CA 122.63 2.22 . . . . 0.0 113.022 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.623 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 78.8 m -75.31 -17.02 60.37 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.349 0.595 . . . . 0.0 109.938 176.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -124.48 -139.11 5.24 Favored Glycine 0 N--CA 1.439 -1.105 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.483 ' HG2' ' H ' ' A' ' 112' ' ' LEU . 75.1 tttt 66.58 175.84 0.24 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 122.415 0.286 . . . . 0.0 110.723 177.324 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.483 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 9.9 mp 71.25 167.46 0.31 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.528 0.731 . . . . 0.0 111.501 178.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.1 p -78.41 116.24 18.69 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.842 179.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.548 ' HB3' ' HD3' ' A' ' 115' ' ' PRO . 40.0 ttmt -135.16 -48.59 0.02 OUTLIER Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.618 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.548 ' HD3' ' HB3' ' A' ' 114' ' ' LYS . 31.4 Cg_exo -68.56 -139.17 0.01 OUTLIER 'Trans proline' 0 C--N 1.375 1.968 0 C-N-CA 121.992 1.795 . . . . 0.0 112.245 175.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 65.6 tttp 62.55 63.13 1.91 Allowed Pre-proline 0 N--CA 1.446 -0.655 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.065 -177.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -42.16 117.96 0.89 Allowed 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 123.521 2.814 . . . . 0.0 111.839 176.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -88.0 93.0 9.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.244 0.545 . . . . 0.0 111.7 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -94.45 78.22 3.86 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.765 177.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -90.69 26.16 2.12 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.029 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 7.2 m -70.65 -23.71 62.57 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.612 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.1 mmtm 70.7 -68.01 0.23 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.882 0.873 . . . . 0.0 111.261 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -140.09 153.81 46.85 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.009 178.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -89.04 -35.78 16.16 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 176.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -122.71 98.96 6.15 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.254 176.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -65.19 -48.47 73.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.095 0.474 . . . . 0.0 110.841 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -150.49 -169.45 3.39 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.432 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 138.33 70.47 0.05 OUTLIER Glycine 0 N--CA 1.441 -1.009 0 C-N-CA 120.19 -1.005 . . . . 0.0 112.154 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -101.96 142.0 33.92 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -82.69 60.2 5.14 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.25 -179.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 63.52 -178.13 0.15 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.443 0.64 . . . . 0.0 111.477 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -108.72 161.7 14.85 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.367 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -88.67 157.11 18.65 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.967 0.413 . . . . 0.0 111.23 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 95.9 mmm -87.28 133.53 33.67 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.682 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -84.46 158.7 20.95 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 -177.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 C--O 1.248 1.007 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.298 -179.545 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.305 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -159.7 179.33 8.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.609 0.243 . . . . 0.0 110.356 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -89.03 86.0 6.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.996 0.427 . . . . 0.0 110.092 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -99.85 159.68 14.89 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.113 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -66.18 128.36 93.79 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.881 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -61.48 -153.65 0.02 OUTLIER 'Trans proline' 0 CA--C 1.504 -0.983 0 C-N-CA 123.643 2.895 . . . . 0.0 114.22 175.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -106.16 55.65 0.67 Allowed 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 112.941 -1.936 . . . . 0.0 111.172 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp 50.46 86.4 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.616 -179.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -115.25 172.12 7.27 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 120.883 0.373 . . . . 0.0 111.402 -178.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -152.48 157.48 4.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.134 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.3 mttp -98.45 160.65 14.14 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.009 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -60.1 109.82 1.06 Allowed 'General case' 0 N--CA 1.439 -1.011 0 CA-C-O 121.09 0.471 . . . . 0.0 111.256 -179.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.8 m -109.4 119.59 39.93 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.415 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -107.26 151.42 25.47 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.936 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 75.9 m 55.35 81.62 0.11 Allowed 'General case' 0 C--O 1.234 0.264 0 O-C-N 123.725 0.641 . . . . 0.0 110.207 -178.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -144.19 -178.98 20.34 Favored Glycine 0 N--CA 1.441 -0.997 0 C-N-CA 120.303 -0.951 . . . . 0.0 114.115 -174.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -73.97 167.95 20.48 Favored 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 123.915 0.886 . . . . 0.0 111.816 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -49.4 125.14 10.52 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 114.648 -1.16 . . . . 0.0 112.159 178.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -115.5 123.06 47.57 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -102.83 133.11 48.45 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.167 0.508 . . . . 0.0 111.781 -175.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.9 p -96.11 170.09 9.51 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.654 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.3 m -87.23 131.01 36.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 122.494 1.14 . . . . 0.0 111.555 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 35' ' ' ARG . 50.9 t -81.15 135.85 35.83 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 112.947 -1.933 . . . . 0.0 112.779 -175.064 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.496 ' O ' ' HA3' ' A' ' 33' ' ' GLY . 57.5 t -100.44 100.65 12.59 Favored Pre-proline 0 N--CA 1.438 -1.054 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 171.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.564 ' O ' ' HB ' ' A' ' 26' ' ' THR . 72.3 Cg_endo -74.89 0.92 8.25 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.782 2.321 . . . . 0.0 113.361 -174.104 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.564 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 17.0 m 80.9 -39.09 0.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.794 0.438 . . . . 0.0 110.611 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.1 t 75.21 179.56 0.19 Allowed 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.616 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.21 8.05 48.15 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.023 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 64.09 10.01 5.1 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.428 0.691 . . . . 0.0 111.577 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 59.2 m -159.14 30.55 0.21 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -109.14 140.11 15.52 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 119.898 -1.144 . . . . 0.0 113.443 -174.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.463 HD12 ' O ' ' A' ' 53' ' ' CYS . 47.6 tp -100.52 127.04 47.0 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 176.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.496 ' HA3' ' O ' ' A' ' 24' ' ' VAL . . . -126.7 -173.49 13.55 Favored Glycine 0 C--N 1.316 -0.544 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.416 HG22 ' HG2' ' A' ' 52' ' ' ARG . 1.3 p -137.02 153.32 50.67 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 118.893 1.346 . . . . 0.0 112.986 -178.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.479 ' HB2' ' HB2' ' A' ' 23' ' ' CYS . 45.3 ttm180 -131.57 137.91 48.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.614 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.438 ' HG2' HG22 ' A' ' 50' ' ' THR . 42.9 mt-10 -115.35 130.41 56.89 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 120.679 0.276 . . . . 0.0 111.029 -178.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -127.88 135.71 8.82 Favored Glycine 0 N--CA 1.435 -1.405 0 N-CA-C 109.038 -1.625 . . . . 0.0 109.038 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 29.8 m -129.06 148.48 51.01 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 117.964 0.882 . . . . 0.0 110.361 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -142.63 162.03 36.53 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.78 145.21 33.03 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -101.65 -158.52 26.73 Favored Glycine 0 N--CA 1.437 -1.235 0 C-N-CA 120.069 -1.062 . . . . 0.0 112.155 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.18 -31.54 72.01 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.15 0.5 . . . . 0.0 110.325 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.5 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 27.9 mm-40 -89.49 2.45 54.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.831 178.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 35.89 59.37 0.88 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -174.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 74.5 mmtt -128.62 143.43 50.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.884 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.513 ' HG3' ' H ' ' A' ' 47' ' ' THR . 18.7 pt20 36.02 -108.7 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.575 1.15 . . . . 0.0 113.886 -178.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.513 ' H ' ' HG3' ' A' ' 46' ' ' GLN . 3.0 p 46.35 45.59 13.4 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.891 0.876 . . . . 0.0 113.189 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -125.48 138.34 53.99 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.808 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -136.18 143.75 44.6 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 121.011 0.434 . . . . 0.0 110.385 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.438 HG22 ' HG2' ' A' ' 36' ' ' GLU . 16.6 p -117.65 137.46 52.63 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.258 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 66.5 mm-40 -122.24 151.81 40.67 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -177.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HG2' HG22 ' A' ' 34' ' ' THR . 83.8 mtm180 -107.92 126.98 53.33 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 176.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.463 ' O ' HD12 ' A' ' 32' ' ' LEU . 36.3 m -88.32 125.23 34.58 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -111.85 138.87 47.87 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 121.124 0.488 . . . . 0.0 112.041 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.1 mm -114.19 106.05 53.43 Favored Pre-proline 0 N--CA 1.436 -1.148 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.42 ' HB2' ' HD3' ' A' ' 60' ' ' LYS . 22.3 Cg_exo -64.67 100.44 0.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.187 1.924 . . . . 0.0 111.358 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.8 t -72.64 -34.05 67.04 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.897 -178.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -71.44 145.22 49.4 Favored 'General case' 0 C--O 1.246 0.877 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.677 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 1.6 p90 -55.36 116.97 3.14 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.293 0.568 . . . . 0.0 110.094 176.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.42 ' HD3' ' HB2' ' A' ' 56' ' ' PRO . 15.3 mtmm -78.5 -80.89 0.11 Allowed 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.368 -175.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 31.9 ttmt 55.48 25.62 8.02 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.454 0.645 . . . . 0.0 111.211 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -132.28 30.82 4.16 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.505 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -66.79 97.81 0.49 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.43 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.578 ' HA3' ' CG ' ' A' ' 69' ' ' TYR . . . 66.67 18.5 68.21 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.643 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.71 -13.51 48.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 0.0 110.743 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -88.96 -5.26 58.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.397 0.618 . . . . 0.0 109.706 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 10.1 p -147.44 -118.08 0.07 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.703 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 92' ' ' ARG . 62.9 mttp -133.38 125.9 30.13 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 122.204 -0.31 . . . . 0.0 110.453 178.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.578 ' CG ' ' HA3' ' A' ' 64' ' ' GLY . 0.3 OUTLIER -130.94 152.9 49.76 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.174 0.511 . . . . 0.0 111.877 -175.997 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -103.27 118.43 36.76 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.22 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -97.6 114.62 26.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -175.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.422 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 6.6 tt0 -123.63 136.83 54.72 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.636 175.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 57.08 36.32 27.5 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.545 0.688 . . . . 0.0 111.179 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -86.62 -23.9 25.54 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.718 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.03 -88.36 0.08 OUTLIER Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 116.054 1.181 . . . . 0.0 116.054 -175.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -117.47 143.88 45.59 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -169.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 8.4 t -69.8 159.32 33.81 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.759 175.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -94.32 115.91 28.2 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-O 121.354 0.597 . . . . 0.0 111.108 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.501 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.6 pt? -71.16 -30.61 66.66 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.958 -178.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -66.9 -33.26 75.2 Favored 'General case' 0 CA--C 1.496 -1.113 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.165 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.502 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 67.8 p -107.72 -8.33 16.11 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.045 -177.14 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.426 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 59.1 38.3 23.91 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.419 -175.136 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 81' ' ' THR . 81.0 mt -130.02 148.84 51.92 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.488 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.767 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 60.6 tttp -127.05 135.53 50.92 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.649 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -139.37 145.78 39.41 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.71 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -136.44 130.06 32.08 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.896 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.422 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 4.0 m -120.87 143.69 48.78 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.309 -179.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -149.84 152.34 24.28 Favored Glycine 0 N--CA 1.436 -1.356 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.899 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.8 m -146.12 144.19 29.83 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.379 -0.411 . . . . 0.0 111.58 177.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.677 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 4.9 tt -72.26 122.45 21.12 Favored 'General case' 0 N--CA 1.432 -1.365 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 176.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.469 ' HE2' ' O ' ' A' ' 69' ' ' TYR . 46.1 pttt -104.93 -12.58 16.15 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -178.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.575 ' HB2' ' HB2' ' A' ' 68' ' ' LYS . 21.2 mmt180 -150.94 134.19 16.12 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -111.17 132.64 54.15 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.411 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.457 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 10.3 mp -94.47 152.61 18.44 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.004 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -76.82 -10.37 59.33 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.95 0.405 . . . . 0.0 111.288 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -125.07 19.93 8.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.281 0.563 . . . . 0.0 111.05 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.457 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -156.23 112.25 3.03 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.701 -178.068 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -91.32 110.97 22.27 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' CYS . . . . . 0.466 ' HB2' ' CD1' ' A' ' 90' ' ' LEU . 91.2 m -101.53 162.64 12.75 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.65 0.738 . . . . 0.0 112.863 -177.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.677 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 11.2 pt20 -66.77 130.49 43.35 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.075 -1.421 . . . . 0.0 108.91 176.148 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.44 ' HA ' ' HB3' ' A' ' 90' ' ' LEU . 29.0 tptp -76.72 -44.97 31.24 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.173 -174.115 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.9 t -151.34 153.05 34.03 Favored 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 119.862 -0.735 . . . . 0.0 111.689 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 m -143.71 136.7 24.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.953 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 89.2 m -130.83 124.25 30.87 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.423 175.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.3 tt -140.6 136.56 35.72 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 CA-C-O 121.453 0.644 . . . . 0.0 111.323 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.8 m -126.56 131.37 51.56 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.44 178.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -133.59 106.99 11.89 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.815 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.12 125.01 16.99 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.33 2.02 . . . . 0.0 111.829 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.767 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 86.8 m -85.52 -178.04 6.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.549 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -107.12 174.06 19.5 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 111.127 -0.789 . . . . 0.0 111.127 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -107.88 168.49 9.24 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.86 0.33 . . . . 0.0 110.713 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 59.1 tp -83.12 138.76 33.54 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.387 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.1 p -76.71 126.63 31.3 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.296 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 59.1 mttp 61.08 73.53 0.59 Allowed Pre-proline 0 N--CA 1.467 0.384 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.773 -178.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' PRO . . . . . 0.412 ' O ' ' HG2' ' A' ' 116' ' ' LYS . 91.0 Cg_exo -51.62 -61.29 0.55 Allowed 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.287 2.658 . . . . 0.0 112.562 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 115' ' ' PRO . 15.5 pttm 41.38 54.7 8.05 Favored Pre-proline 0 CA--C 1.553 1.081 0 C-N-CA 123.999 0.92 . . . . 0.0 113.236 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.49 135.66 70.26 Favored 'Trans proline' 0 C--N 1.366 1.475 0 C-N-CA 122.398 2.065 . . . . 0.0 111.869 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -71.08 -48.18 53.95 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.13 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -165.06 139.09 4.88 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.643 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -140.55 135.7 32.1 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.095 0.474 . . . . 0.0 111.028 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 33.0 t -128.2 106.24 8.9 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.178 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 18.6 pttp -127.36 86.26 2.47 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.376 0.608 . . . . 0.0 110.414 178.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -115.0 136.08 53.52 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.312 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -165.59 155.76 13.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.843 0.354 . . . . 0.0 110.919 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -130.81 89.12 2.71 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.591 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 68.2 mttm 59.24 -168.14 0.15 Allowed 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.45 -178.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -159.08 174.54 14.75 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.525 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 125.48 -122.48 4.6 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.281 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -117.57 147.11 43.12 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.893 0.377 . . . . 0.0 111.044 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -157.33 142.42 16.99 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.38 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 73.21 -43.35 0.56 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.353 0.661 . . . . 0.0 111.316 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -72.41 129.85 39.32 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? 69.52 147.52 0.06 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.572 0.749 . . . . 0.0 110.84 -177.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 88.3 mtp 64.91 19.32 11.82 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.39 0.614 . . . . 0.0 110.709 -177.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 56.1 tp -89.4 127.54 35.83 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.786 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 . . . . . 0 C--N 1.307 -1.276 0 CA-C-O 118.472 -0.775 . . . . 0.0 110.629 -179.125 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.308 -0.317 . . . . 0.0 112.308 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt 55.34 73.29 0.43 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.476 0.655 . . . . 0.0 110.472 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.55 -171.86 2.08 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.672 -177.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 72.86 -58.22 0.61 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.866 0.866 . . . . 0.0 111.92 178.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.9 mttm 64.82 94.52 0.05 OUTLIER Pre-proline 0 N--CA 1.47 0.529 0 O-C-N 123.671 0.607 . . . . 0.0 111.625 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.427 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 10.9 Cg_endo -83.33 -133.33 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.91 2.406 . . . . 0.0 110.882 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.427 ' H ' ' HB2' ' A' ' 6' ' ' PRO . 24.1 mt-10 -88.68 87.14 7.15 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.461 -178.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -176.17 116.35 0.13 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.139 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -93.35 144.21 25.54 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-O 120.771 0.32 . . . . 0.0 111.135 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.6 p -154.17 140.19 11.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-O 121.39 0.614 . . . . 0.0 110.548 178.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.2 pttt -103.24 127.32 50.59 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.224 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.466 ' HB2' ' OE1' ' A' ' 19' ' ' GLN . 60.7 mttp -61.2 -63.84 1.15 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.159 0.504 . . . . 0.0 110.115 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.1 m -153.31 108.46 3.2 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.72 177.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -77.79 136.12 38.07 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.737 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 39.4 m 62.05 70.6 0.57 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 122.033 0.92 . . . . 0.0 110.261 -178.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -156.67 178.87 32.89 Favored Glycine 0 N--CA 1.45 -0.407 0 CA-C-N 114.266 -1.334 . . . . 0.0 113.192 -176.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 19' ' ' GLN . 42.0 mm-40 -74.86 169.17 18.46 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.028 0.531 . . . . 0.0 111.737 -178.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.594 ' CD2' ' HB2' ' A' ' 39' ' ' ARG . 94.7 m95 -48.27 119.48 3.0 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.066 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 28.2 mt-30 -108.83 115.73 30.64 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 177.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -105.26 145.12 31.1 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-O 121.686 0.755 . . . . 0.0 112.95 -174.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -93.64 175.23 6.82 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.89 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.3 m -94.2 129.18 44.84 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -176.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.75 96.05 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.396 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -102.03 101.04 16.73 Favored Pre-proline 0 N--CA 1.439 -1.01 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.652 ' O ' ' HB ' ' A' ' 26' ' ' THR . 56.9 Cg_endo -71.98 -20.78 25.12 Favored 'Trans proline' 0 C--O 1.207 -1.07 0 C-N-CA 122.277 1.984 . . . . 0.0 111.068 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.652 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 7.8 m 107.41 -32.47 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.948 1.299 . . . . 0.0 110.155 177.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.9 t 75.51 -162.32 0.06 Allowed 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.482 175.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.97 -93.62 1.05 Allowed Glycine 0 CA--C 1.49 -1.53 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -175.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.459 ' O ' ' HB2' ' A' ' 30' ' ' CYS . 9.8 p-10 -160.13 58.93 0.35 Allowed 'General case' 0 C--N 1.284 -2.271 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 177.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 29' ' ' ASP . 83.3 m 83.14 97.41 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 112.717 -2.038 . . . . 0.0 110.135 -176.071 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -127.3 156.45 20.39 Favored Glycine 0 N--CA 1.434 -1.484 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.826 -178.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.5 tp -80.95 131.39 35.33 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.947 0.374 . . . . 0.0 110.29 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 25' ' ' PRO . . . -139.82 173.93 22.63 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 -176.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 p -143.55 160.14 41.16 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -174.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 35' ' ' ARG . 42.2 ttp180 -137.41 137.15 38.5 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.927 176.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.12 132.44 56.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.722 -0.217 . . . . 0.0 111.145 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -133.02 128.29 5.05 Favored Glycine 0 N--CA 1.445 -0.752 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 176.141 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.418 HG22 ' HB2' ' A' ' 48' ' ' MET . 66.5 p -130.99 146.9 52.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 117.532 0.666 . . . . 0.0 110.65 -176.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.594 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 6.7 ttp85 -143.83 155.51 44.15 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.568 HG22 ' H ' ' A' ' 46' ' ' GLN . 0.7 OUTLIER -149.44 144.0 26.06 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-O 120.781 0.324 . . . . 0.0 110.172 176.928 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.89 -173.48 49.41 Favored Glycine 0 CA--C 1.499 -0.925 0 N-CA-C 110.275 -1.13 . . . . 0.0 110.275 176.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.61 -30.91 69.02 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.342 0.591 . . . . 0.0 109.998 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -89.17 6.33 40.58 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.76 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 10.1 m 46.95 79.63 0.06 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.575 0.702 . . . . 0.0 112.589 -175.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.7 tptt -82.75 2.83 31.95 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.901 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.568 ' H ' HG22 ' A' ' 40' ' ' THR . 93.4 mt-30 48.67 56.27 7.85 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.915 -178.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 m -89.72 102.75 15.44 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.135 0.493 . . . . 0.0 109.937 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.418 ' HB2' HG22 ' A' ' 38' ' ' THR . 20.5 ptp -136.7 146.29 45.7 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-O 121.078 0.466 . . . . 0.0 111.902 -176.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.437 ' HA ' ' HE3' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -143.04 143.27 31.82 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.484 179.535 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 18.7 m -115.82 138.16 51.41 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.143 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -133.4 146.44 51.22 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.183 0.516 . . . . 0.0 111.518 -175.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -85.0 137.36 33.12 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 176.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.0 t -91.21 154.51 19.25 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 -177.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -112.85 138.87 49.04 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.219 0.533 . . . . 0.0 111.2 -176.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 4.9 tp -118.38 112.79 37.29 Favored Pre-proline 0 C--N 1.319 -0.729 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.888 -178.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.39 106.54 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.668 2.245 . . . . 0.0 112.079 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 79.7 m -95.9 178.23 5.5 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.146 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -70.62 147.33 49.31 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.67 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 63.9 p-90 -62.34 165.75 5.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.069 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -131.52 177.6 7.37 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.604 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -92.51 -2.6 56.11 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.441 0.639 . . . . 0.0 109.437 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -137.02 100.43 4.28 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.482 ' HB3' ' NE2' ' A' ' 100' ' ' GLN . 98.8 m-85 -82.08 47.28 1.1 Allowed 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.17 -174.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.65 179.27 24.43 Favored Glycine 0 N--CA 1.442 -0.911 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.017 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -112.56 -62.95 1.5 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.937 0.398 . . . . 0.0 110.426 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.11 -5.51 25.58 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.535 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.457 ' SG ' HD21 ' A' ' 90' ' ' LEU . 11.8 t -76.78 167.82 21.16 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 176.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.415 ' O ' HD22 ' A' ' 90' ' ' LEU . 56.3 mttp -125.08 125.58 44.01 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.018 -177.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.417 ' HE1' ' HB2' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -124.56 153.56 41.95 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.802 -178.424 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -100.81 140.22 35.4 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.217 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -96.31 139.76 31.98 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.743 0.817 . . . . 0.0 109.008 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.404 HE21 ' HB3' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -77.97 164.76 24.81 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.75 28.97 1.25 Allowed 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -176.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 48.8 t-105 -87.31 -14.03 41.98 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.794 -175.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 108.11 127.07 5.56 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 119.884 -1.151 . . . . 0.0 111.075 -175.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -105.46 134.11 49.12 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-O 120.763 0.315 . . . . 0.0 111.547 -178.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 52.7 t 68.12 104.29 0.05 Allowed 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.809 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.485 ' HB2' ' OG1' ' A' ' 81' ' ' THR . 20.6 m-20 -87.49 112.06 21.81 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 177.284 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.38 -30.22 68.16 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.795 -175.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -67.83 -29.93 69.21 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.254 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.57 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.5 p -104.45 -8.23 19.27 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.566 -0.453 . . . . 0.0 111.163 -177.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.454 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 59.67 30.39 20.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.512 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 81' ' ' THR . 67.3 mt -129.06 160.37 33.0 Favored 'General case' 0 CA--C 1.498 -1.032 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.204 -175.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 109' ' ' CYS . 35.6 tttp -129.06 140.33 51.65 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.218 -178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.4 t -137.81 145.32 42.18 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.535 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 mtt180 -140.34 128.99 22.95 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.14 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.2 t -123.82 146.78 48.12 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.928 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -150.08 152.33 24.26 Favored Glycine 0 N--CA 1.437 -1.278 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.16 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.9 m -138.85 148.72 44.06 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.113 0.482 . . . . 0.0 111.976 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.7 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.3 tm? -79.49 126.14 30.47 Favored 'General case' 0 N--CA 1.423 -1.811 0 C-N-CA 123.939 0.895 . . . . 0.0 109.121 178.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -87.53 -33.77 18.84 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.326 -0.55 . . . . 0.0 112.325 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -160.71 141.03 11.36 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -105.22 152.51 22.77 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.935 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.689 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 3.2 mm? -91.02 176.21 6.68 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.889 0.376 . . . . 0.0 110.752 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -73.95 -27.85 61.21 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.888 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -130.45 43.69 3.08 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.697 0.761 . . . . 0.0 109.971 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.689 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -152.11 97.93 2.37 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.142 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -80.32 110.57 15.88 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 71.4 m -110.76 152.8 26.18 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.122 0.487 . . . . 0.0 111.607 -177.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.7 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 4.8 pm0 -68.46 132.71 47.47 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.677 177.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -74.25 -43.2 57.93 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 122.692 0.397 . . . . 0.0 111.333 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.3 t -155.52 146.41 22.35 Favored 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 119.216 -0.994 . . . . 0.0 112.101 175.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.0 m -133.13 138.56 51.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.545 176.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 58.3 m -129.83 127.85 41.11 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 114.726 -1.125 . . . . 0.0 108.993 177.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 19.8 pt -136.69 136.63 48.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-O 120.919 0.39 . . . . 0.0 111.163 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.6 t -126.85 135.36 50.88 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.909 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -135.53 130.98 19.16 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.415 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -52.33 126.53 20.85 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 121.27 1.313 . . . . 0.0 109.946 174.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 84' ' ' LYS . 33.7 t -101.33 -46.18 5.1 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -172.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -62.44 -41.57 99.76 Favored Glycine 0 CA--C 1.509 -0.337 0 C-N-CA 121.085 -0.578 . . . . 0.0 113.095 -175.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 8.0 ttpm? -120.31 135.64 54.95 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-O 120.704 0.287 . . . . 0.0 110.318 -178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 89.2 mt -76.88 109.76 10.95 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.684 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 7.7 p -91.76 114.1 26.55 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.638 177.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.91 82.85 60.5 Favored Pre-proline 0 C--N 1.312 -1.054 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.965 -179.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -65.29 165.12 23.19 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.373 2.716 . . . . 0.0 113.124 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -137.43 64.12 44.27 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.726 173.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.01 101.64 0.16 Allowed 'Trans proline' 0 C--N 1.355 0.908 0 C-N-CA 122.402 2.068 . . . . 0.0 112.13 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -76.11 -46.37 29.24 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 56.41 -171.7 0.08 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-N 114.649 -1.159 . . . . 0.0 112.575 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -122.58 167.56 13.25 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.825 177.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 13.5 t -76.88 93.06 3.7 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-O 121.263 0.554 . . . . 0.0 109.671 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -92.08 104.69 17.05 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.02 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.419 ' HE2' ' O ' ' A' ' 125' ' ' LYS . 26.0 pttm -113.49 156.78 22.94 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.597 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 124' ' ' LYS . 38.5 ttmt -85.48 -33.31 21.88 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.192 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.419 ' O ' ' HE2' ' A' ' 123' ' ' LYS . 87.2 tttt -62.65 136.47 57.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.936 178.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -86.16 -177.13 6.19 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 120.866 0.365 . . . . 0.0 110.811 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -85.03 86.24 7.4 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -147.0 101.92 0.24 Allowed Glycine 0 N--CA 1.437 -1.271 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.205 -178.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -145.75 145.66 30.92 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 98.5 mttt 62.91 -169.77 0.18 Allowed 'General case' 0 C--O 1.24 0.562 0 O-C-N 123.62 0.575 . . . . 0.0 109.949 -175.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 56.73 68.79 0.81 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.192 0.52 . . . . 0.0 111.414 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -112.04 129.48 56.19 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.161 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.0 mttt 61.12 82.83 0.16 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.412 0.625 . . . . 0.0 111.287 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 84.5 mtp -83.06 131.02 35.18 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.856 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 92.1 mt 62.24 25.85 15.47 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.17 0.588 . . . . 0.0 111.142 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 C--O 1.245 0.862 0 CA-C-O 118.495 -0.764 . . . . 0.0 110.628 179.689 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.039 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -92.91 166.27 12.48 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 117.085 0.443 . . . . 0.0 112.141 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.6 m95 -50.32 122.14 6.55 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.654 176.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -111.82 124.29 52.05 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.429 ' CE3' ' HA3' ' A' ' 37' ' ' GLY . 98.2 m95 -104.46 136.8 43.34 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.39 0.614 . . . . 0.0 112.169 -175.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.0 m -95.42 172.07 8.31 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.192 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.0 m -90.39 130.97 38.77 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 CA-C-O 121.756 0.788 . . . . 0.0 111.034 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 43.4 t -61.18 134.46 57.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.35 -1.295 . . . . 0.0 112.168 -176.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.9 t -96.8 107.93 39.99 Favored Pre-proline 0 N--CA 1.438 -1.045 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.56 ' O ' ' HB ' ' A' ' 26' ' ' THR . 18.1 Cg_endo -59.55 -19.03 50.3 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.935 2.423 . . . . 0.0 112.713 -176.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.56 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 30.7 m 85.98 -66.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.029 177.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.2 t 68.23 121.69 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.463 0.649 . . . . 0.0 111.081 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 161.05 66.53 0.02 OUTLIER Glycine 0 CA--C 1.494 -1.257 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.407 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 62.07 40.3 12.18 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 39.1 m 76.91 88.91 0.08 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.126 -178.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.63 149.43 16.87 Favored Glycine 0 CA--C 1.503 -0.665 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.4 tp -78.94 116.43 19.25 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.054 0.454 . . . . 0.0 112.089 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.31 162.32 34.9 Favored Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.085 178.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 p -136.13 154.53 50.95 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.465 0.65 . . . . 0.0 112.402 -177.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -125.21 138.44 54.12 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -118.77 129.08 55.05 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.905 0.383 . . . . 0.0 110.999 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.429 ' HA3' ' CE3' ' A' ' 20' ' ' TRP . . . -124.55 143.5 14.72 Favored Glycine 0 N--CA 1.437 -1.238 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 177.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.621 HG22 ' HB3' ' A' ' 48' ' ' MET . 50.7 p -133.3 158.41 43.02 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 117.637 0.719 . . . . 0.0 110.727 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.517 ' HG2' ' N ' ' A' ' 40' ' ' THR . 71.7 ttt180 -154.73 161.1 41.66 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.64 ' HA ' ' O ' ' A' ' 45' ' ' LYS . 1.3 p -106.58 145.79 31.47 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 174.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.89 -176.99 31.57 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.099 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.39 -25.77 63.4 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.567 0.699 . . . . 0.0 110.441 -177.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -98.16 16.36 21.53 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.91 178.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 73.4 m 61.23 79.74 0.24 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.323 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.64 ' O ' ' HA ' ' A' ' 40' ' ' THR . 75.8 mmtt -130.36 146.03 51.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 177.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -74.75 108.46 7.51 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.03 0.443 . . . . 0.0 110.873 -177.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -115.8 136.59 52.91 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.621 ' HB3' HG22 ' A' ' 38' ' ' THR . 16.3 ptm -144.96 154.34 42.47 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -147.71 142.59 26.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.642 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.1 m -116.86 138.81 51.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 120.848 0.356 . . . . 0.0 110.476 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -120.48 152.66 37.71 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -104.78 127.35 52.55 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 57.6 m -90.69 -165.39 1.34 Allowed 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -175.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -117.55 140.06 50.12 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 120.772 0.32 . . . . 0.0 110.921 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 6.9 tp -109.77 120.22 45.53 Favored Pre-proline 0 C--N 1.305 -1.353 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.709 -178.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -62.51 103.44 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.368 2.045 . . . . 0.0 111.37 177.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.313 -0.996 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.572 -179.657 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.094 0 CA-C-O 120.896 0.165 . . . . 0.0 112.797 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -156.2 -79.87 0.08 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -89.6 -20.72 23.39 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.403 ' HA ' HD13 ' A' ' 94' ' ' LEU . 45.0 t -76.24 178.74 6.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.425 176.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -132.76 125.82 31.02 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.53 -178.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.438 ' HE1' ' O ' ' A' ' 100' ' ' GLN . 1.6 t80 -141.23 141.36 34.02 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.766 -177.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -123.7 134.02 53.79 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 110.498 -0.186 . . . . 0.0 110.498 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -97.09 131.64 43.67 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 176.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.485 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 3.6 pt20 -115.66 161.75 18.23 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -135.97 106.04 6.31 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 121.141 0.496 . . . . 0.0 111.288 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 59.3 t90 -79.06 -21.7 46.41 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.211 176.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -159.59 158.46 29.64 Favored Glycine 0 N--CA 1.434 -1.492 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.191 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -94.33 146.63 23.91 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 2.1 t -21.33 126.58 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.225 0 O-C-N 124.563 1.164 . . . . 0.0 112.58 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -98.29 109.16 21.96 Favored 'General case' 0 CA--C 1.494 -1.207 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 mt -75.51 -21.21 58.19 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -177.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -67.17 -36.48 81.89 Favored 'General case' 0 CA--C 1.486 -1.496 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -174.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 74.1 p -104.87 -7.28 19.48 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.875 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.425 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 61.95 37.31 15.15 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.348 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.458 ' HA ' ' H ' ' A' ' 109' ' ' CYS . 66.3 mt -128.1 152.31 48.14 Favored 'General case' 0 CA--C 1.498 -1.057 0 CA-C-O 121.276 0.56 . . . . 0.0 111.873 -176.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 109' ' ' CYS . 87.0 tttt -135.65 136.48 41.0 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.725 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.1 t -134.52 144.49 48.05 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 120.904 0.383 . . . . 0.0 111.551 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -142.54 142.87 32.28 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.925 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.485 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 5.0 m -112.61 147.21 37.16 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.651 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -133.82 156.49 22.34 Favored Glycine 0 C--N 1.318 -0.467 0 C-N-CA 121.14 -0.552 . . . . 0.0 111.937 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.7 p -146.31 141.7 27.55 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-N 116.955 0.378 . . . . 0.0 111.941 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.622 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 5.3 tt -68.78 127.47 33.18 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.331 176.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -97.57 -31.47 12.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.613 178.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -156.77 140.07 15.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.617 0.246 . . . . 0.0 110.876 178.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.414 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -113.94 131.51 56.29 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.518 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 8.7 mp -93.19 175.94 6.59 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -178.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -76.7 -27.94 55.68 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.692 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -126.49 14.09 7.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.028 0.918 . . . . 0.0 110.698 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.518 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -143.23 91.2 2.25 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.111 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -103.61 152.63 21.53 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.721 -176.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . 0.445 ' HB2' HD12 ' A' ' 90' ' ' LEU . 67.8 m -134.91 156.19 49.4 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 121.295 0.569 . . . . 0.0 111.855 -177.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.622 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 19.5 pm0 -64.02 149.91 46.43 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.801 -1.091 . . . . 0.0 108.449 169.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.509 ' HA ' ' HB3' ' A' ' 90' ' ' LEU . 57.3 pttt -81.52 -31.69 32.68 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -173.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.0 t -155.69 148.82 24.55 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 119.387 -0.925 . . . . 0.0 112.451 177.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 26.8 m -134.27 143.02 39.3 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.15 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.275 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 12.2 t -128.18 128.95 45.72 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-N 114.482 -1.236 . . . . 0.0 107.912 175.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.9 tt -141.07 139.69 33.23 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 CA-C-O 121.221 0.534 . . . . 0.0 111.375 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 16.3 m -130.41 127.48 39.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -133.52 132.53 21.91 Favored Pre-proline 0 C--N 1.305 -1.365 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.447 ' HA ' HD23 ' A' ' 83' ' ' LEU . 50.8 Cg_exo -51.21 118.07 3.98 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 121.561 1.507 . . . . 0.0 110.956 178.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.458 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 9.4 t -77.52 -30.06 52.71 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.239 -176.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.279 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 178.026 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.38 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -109.46 166.17 11.09 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.518 0.675 . . . . 0.0 111.243 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.422 ' HA ' ' O ' ' A' ' 38' ' ' THR . 98.6 m95 -65.08 128.98 38.05 Favored 'General case' 0 N--CA 1.418 -2.067 0 CA-C-N 114.462 -1.245 . . . . 0.0 111.413 174.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -87.66 137.96 31.88 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 176.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -110.27 124.02 50.87 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 121.324 0.583 . . . . 0.0 112.329 -174.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.0 m -107.13 168.51 9.16 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.21 -0.905 . . . . 0.0 108.961 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.6 m -96.51 152.9 3.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.569 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 79.3 m -66.91 129.85 41.24 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.788 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 17.1 m -109.29 111.1 60.14 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.799 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.06 156.83 63.96 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.404 2.07 . . . . 0.0 111.686 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.6 m -91.25 -25.81 19.31 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-O 121.247 0.546 . . . . 0.0 109.549 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -160.56 136.75 8.54 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.644 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -69.94 -26.96 73.69 Favored Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -80.99 54.24 2.16 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.4 m 59.41 88.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.114 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.519 ' H ' HD13 ' A' ' 55' ' ' ILE . . . -144.34 141.82 10.48 Favored Glycine 0 N--CA 1.437 -1.252 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.531 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.7 tp -57.04 152.15 13.73 Favored 'General case' 0 C--O 1.203 -1.392 0 C-N-CA 122.502 0.321 . . . . 0.0 111.38 -177.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.0 171.77 22.31 Favored Glycine 0 N--CA 1.438 -1.23 0 N-CA-C 110.57 -1.012 . . . . 0.0 110.57 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.4 p -135.68 154.18 51.37 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 117.441 0.62 . . . . 0.0 112.06 -178.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -137.09 142.2 42.35 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 175.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -130.25 130.87 45.14 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 120.757 0.313 . . . . 0.0 111.627 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.54 145.81 17.52 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.422 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 71.2 p -134.91 154.76 51.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 117.843 0.821 . . . . 0.0 111.115 -177.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -118.11 154.51 31.99 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.2 m -150.73 161.87 41.8 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.387 -175.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 166.16 -173.44 41.68 Favored Glycine 0 N--CA 1.434 -1.47 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.54 -32.72 64.36 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 117.593 0.696 . . . . 0.0 111.411 -178.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -105.52 0.97 27.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.961 0.41 . . . . 0.0 111.843 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 78.2 m -98.71 117.32 32.91 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 120.91 0.386 . . . . 0.0 111.858 -177.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.77 140.56 40.68 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.793 175.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 62.53 19.79 11.49 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.671 0.607 . . . . 0.0 111.466 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -84.11 77.89 9.86 Favored 'General case' 0 N--CA 1.437 -1.105 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 177.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 55.2 mtt -134.31 152.86 52.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.057 -175.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -148.54 131.45 16.15 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.374 178.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.2 m -117.1 138.02 51.91 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -131.62 152.24 50.98 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 120.729 0.299 . . . . 0.0 110.824 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -85.95 129.44 34.83 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 176.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 9.1 t -95.78 178.83 5.32 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -175.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -113.65 141.14 47.58 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.438 0.637 . . . . 0.0 111.284 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.519 HD13 ' H ' ' A' ' 31' ' ' GLY . 12.4 tt -123.59 120.29 26.93 Favored Pre-proline 0 C--N 1.299 -1.605 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.64 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 55' ' ' ILE . 12.4 Cg_exo -70.41 98.44 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.375 2.05 . . . . 0.0 111.822 178.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 54.1 t . . . . . 0 C--N 1.313 -0.983 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.924 178.807 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.923 0 N-CA-C 111.626 -0.589 . . . . 0.0 111.626 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.06 -75.99 0.59 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.622 0.248 . . . . 0.0 110.701 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -93.68 -21.58 19.27 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.161 0.505 . . . . 0.0 110.588 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 56.3 m -83.42 160.52 21.56 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.378 178.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -130.81 127.82 39.43 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.858 ' CE2' ' HB2' ' A' ' 90' ' ' LEU . 54.8 m-85 -109.27 128.47 55.1 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.611 -178.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -100.51 117.58 34.94 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 177.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.565 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 44.2 p90 -99.02 145.11 27.41 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-O 120.83 0.347 . . . . 0.0 111.158 -176.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -89.78 162.34 15.57 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 71.74 116.85 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.16 0.912 . . . . 0.0 110.661 -175.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -89.11 -3.12 58.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.757 0.789 . . . . 0.0 109.826 -177.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.92 140.13 11.54 Favored Glycine 0 N--CA 1.436 -1.336 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.943 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -107.98 141.23 39.95 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.626 ' HA ' ' HB3' ' A' ' 84' ' ' LYS . 48.9 t 79.53 102.24 0.07 Allowed 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 121.662 0.744 . . . . 0.0 110.777 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -83.73 111.85 19.54 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 114.874 -1.057 . . . . 0.0 108.51 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.552 ' H ' HD23 ' A' ' 79' ' ' LEU . 2.5 pt? -63.82 -31.81 73.12 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.612 -1.176 . . . . 0.0 113.254 -173.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -74.95 -28.7 60.69 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.438 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.626 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.7 p -105.19 -8.55 18.29 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 120.004 -0.678 . . . . 0.0 112.44 -175.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.32 25.08 12.33 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 123.466 0.706 . . . . 0.0 110.625 -175.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 81' ' ' THR . 44.9 mt -128.71 149.49 50.67 Favored 'General case' 0 C--O 1.202 -1.437 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.121 -177.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.626 ' HB3' ' HA ' ' A' ' 77' ' ' CYS . 8.3 ptmt -121.58 135.46 55.0 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 120.879 0.371 . . . . 0.0 110.246 177.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.3 m -137.95 138.3 38.82 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -177.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -140.33 136.42 33.19 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 120.814 0.34 . . . . 0.0 110.179 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.5 m -128.75 134.23 48.36 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.63 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.565 ' HA2' ' HA ' ' A' ' 71' ' ' PHE . . . -135.69 152.3 20.92 Favored Glycine 0 CA--C 1.495 -1.214 0 C-N-CA 120.466 -0.874 . . . . 0.0 111.784 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 20.1 p -141.04 146.42 37.18 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.24 0.543 . . . . 0.0 111.961 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.858 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.8 tm? -91.29 121.46 33.05 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -97.4 -12.39 22.81 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -174.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 92' ' ' ARG . 14.9 ttm180 -161.57 133.76 5.8 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.564 0.221 . . . . 0.0 110.496 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -113.6 148.6 35.91 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.448 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 9.8 mp -85.74 172.09 11.09 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 -178.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -78.46 -18.38 54.95 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.112 0.482 . . . . 0.0 110.404 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -119.63 37.6 4.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.698 0.761 . . . . 0.0 109.706 179.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.448 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -157.63 124.26 4.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.335 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -111.1 122.98 49.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.648 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . 0.455 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 74.7 m -145.68 148.3 32.9 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.956 -0.566 . . . . 0.0 112.177 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.74 152.54 45.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.267 178.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -73.52 -35.72 65.62 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.915 -175.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 9.3 t -156.26 148.91 23.8 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 118.877 -1.129 . . . . 0.0 113.449 179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.1 m -131.63 139.26 51.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 113.8 -1.546 . . . . 0.0 110.83 175.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 56.7 m -129.74 133.78 47.22 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.411 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.48 132.08 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 4.8 m -131.82 126.28 33.94 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -135.5 138.17 27.89 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -62.71 123.15 11.81 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 121.7 1.6 . . . . 0.0 110.252 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.417 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 13.4 t -83.16 178.37 8.14 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.763 0.316 . . . . 0.0 110.479 -176.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.759 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -177.942 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.799 0 N-CA-C 112.193 -0.363 . . . . 0.0 112.193 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 19' ' ' GLN . 42.3 mt-10 -75.83 171.3 14.62 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 122.46 0.304 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.677 ' HA ' ' O ' ' A' ' 38' ' ' THR . 88.5 m95 -45.92 119.51 2.27 Favored 'General case' 0 N--CA 1.442 -0.839 0 O-C-N 123.894 0.746 . . . . 0.0 112.698 -177.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.47 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 68.3 mt-30 -113.15 115.56 28.46 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -100.45 138.69 37.17 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.225 0.536 . . . . 0.0 111.481 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.0 t -101.33 172.44 6.99 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.416 -0.811 . . . . 0.0 108.895 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 29.1 m -91.95 148.56 4.56 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 62.3 m -63.6 128.41 35.7 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.829 -175.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 p -106.23 114.79 61.99 Favored Pre-proline 0 N--CA 1.44 -0.93 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -61.29 148.09 93.83 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.599 2.2 . . . . 0.0 112.972 -176.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.3 m -87.64 -28.53 21.81 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-O 121.678 0.752 . . . . 0.0 109.195 178.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 46.3 t -149.95 134.58 17.56 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.888 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.07 -30.57 69.78 Favored Glycine 0 CA--C 1.504 -0.616 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.338 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -68.17 -41.47 81.44 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.3 m 166.02 92.15 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.583 1.153 . . . . 0.0 110.847 178.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -141.31 120.09 1.62 Allowed Glycine 0 CA--C 1.498 -0.976 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.895 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.452 ' H ' HD22 ' A' ' 32' ' ' LEU . 3.2 mm? -53.68 114.13 1.43 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.998 0.428 . . . . 0.0 111.671 -176.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.96 175.77 53.96 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.886 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 p -136.42 154.66 50.73 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -133.71 146.04 50.44 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.001 176.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -120.82 131.56 54.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.514 0.197 . . . . 0.0 110.649 -178.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.47 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -128.21 151.37 18.76 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 178.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.677 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 58.8 p -130.0 149.37 51.75 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 117.395 0.598 . . . . 0.0 111.25 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.502 ' HB2' ' CE2' ' A' ' 18' ' ' TRP . 53.2 ttp180 -132.24 161.4 33.53 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.496 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 9.0 t -113.75 162.7 15.97 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-O 121.756 0.788 . . . . 0.0 111.087 178.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -111.82 -174.29 19.67 Favored Glycine 0 C--N 1.294 -1.788 0 CA-C-N 114.042 -1.435 . . . . 0.0 110.058 177.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.94 -30.51 69.83 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 117.562 0.681 . . . . 0.0 110.099 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -101.93 5.44 40.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.412 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.429 ' HA ' ' OG1' ' A' ' 40' ' ' THR . 52.9 t 60.51 70.85 0.6 Allowed 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.991 -175.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -90.89 -18.41 24.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.055 -178.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 39' ' ' ARG . 15.3 mm100 66.74 100.56 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.893 0.854 . . . . 0.0 112.829 178.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 m -101.72 143.32 31.8 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 114.74 -1.118 . . . . 0.0 108.542 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -120.85 152.59 38.21 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.18 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -141.89 136.07 30.12 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.9 m -129.77 136.72 49.96 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -133.64 151.1 51.6 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-O 121.053 0.454 . . . . 0.0 111.294 -176.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.463 ' HD2' ' N ' ' A' ' 52' ' ' ARG . 0.2 OUTLIER -101.91 128.1 48.45 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.44 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 31.7 m -92.65 170.58 9.61 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 -174.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.7 mttm -113.79 139.91 48.74 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.371 0.605 . . . . 0.0 112.125 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.9 mt -112.37 131.54 22.55 Favored Pre-proline 0 C--N 1.305 -1.369 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.631 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.449 ' O ' ' HB2' ' A' ' 57' ' ' CYS . 9.5 Cg_endo -52.45 -54.5 5.08 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.426 2.75 . . . . 0.0 113.486 -178.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 56' ' ' PRO . 41.9 m . . . . . 0 N--CA 1.472 0.672 0 C-N-CA 123.085 0.554 . . . . 0.0 112.357 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.949 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -132.66 1.19 3.66 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -82.92 -20.93 34.41 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.245 0.545 . . . . 0.0 110.455 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.404 ' HB2' HD21 ' A' ' 90' ' ' LEU . 6.5 p -99.67 -176.48 3.28 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 175.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -129.85 142.44 50.67 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.491 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.429 ' CE2' HD23 ' A' ' 90' ' ' LEU . 29.6 m-85 -117.44 152.49 34.89 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.01 -178.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -124.96 118.77 26.98 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.406 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 28.3 p90 -95.79 135.57 37.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.201 0.524 . . . . 0.0 111.135 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.482 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 0.2 OUTLIER -110.5 162.17 14.96 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.808 -178.577 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -124.55 87.27 2.69 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.152 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 47.9 t-105 -87.24 -24.35 24.42 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.417 0.627 . . . . 0.0 109.526 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -161.62 118.19 0.81 Allowed Glycine 0 N--CA 1.439 -1.154 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.764 178.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -96.85 116.23 28.8 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.491 ' SG ' ' HG3' ' A' ' 84' ' ' LYS . 55.7 m 59.99 102.06 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.917 0.76 . . . . 0.0 112.022 -176.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -69.81 111.94 5.9 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 177.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 20.2 mt -69.29 -28.93 66.71 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.695 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -65.27 -38.59 90.77 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.219 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 65.7 p -106.72 -14.59 14.97 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.278 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 69.48 39.89 1.53 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.921 -1.036 . . . . 0.0 108.727 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.464 ' HA ' ' H ' ' A' ' 109' ' ' CYS . 90.3 mt -125.34 168.01 14.13 Favored 'General case' 0 C--O 1.204 -1.321 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.859 -178.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.491 ' HG3' ' SG ' ' A' ' 77' ' ' CYS . 36.1 tttm -121.15 137.44 54.67 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -177.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 14.2 t -137.12 146.7 45.37 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.495 0.664 . . . . 0.0 110.878 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -137.56 135.54 36.77 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.39 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.482 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 33.4 m -107.44 141.97 38.0 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.406 ' HA2' ' HA ' ' A' ' 71' ' ' PHE . . . -136.47 152.57 21.25 Favored Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 178.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.494 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 19.0 m -141.08 147.94 39.37 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.063 0.459 . . . . 0.0 111.28 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.587 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.1 tm? -72.73 119.03 16.4 Favored 'General case' 0 N--CA 1.408 -2.571 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.388 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -105.39 -25.69 12.27 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 120.429 -0.509 . . . . 0.0 111.114 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -155.85 133.61 11.15 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.042 0.448 . . . . 0.0 111.004 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -135.47 150.72 49.89 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.788 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.4 mp -84.49 158.99 20.82 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 177.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -68.29 -27.08 66.0 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.757 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -100.37 38.85 1.43 Allowed 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.509 0.671 . . . . 0.0 109.304 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.83 99.26 1.39 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.626 -177.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -84.23 133.19 34.59 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.974 179.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 74.8 m -145.94 140.71 27.13 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.811 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.587 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -67.54 153.87 42.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.707 178.647 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.61 ' HD3' ' H ' ' A' ' 101' ' ' LYS . 0.3 OUTLIER -73.93 -26.52 60.56 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.316 -174.671 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.494 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 8.8 t -149.22 149.82 31.59 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-O 122.016 0.912 . . . . 0.0 113.043 179.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 29.6 m -129.17 144.04 39.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 113.857 -1.52 . . . . 0.0 110.749 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 34.6 m -129.51 131.8 46.72 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.839 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.09 136.39 47.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.807 0.337 . . . . 0.0 110.358 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.3 p -123.18 137.0 55.0 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.549 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -134.46 128.78 19.32 Favored Pre-proline 0 C--O 1.21 -1.019 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.553 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -50.29 126.21 16.95 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 122.129 1.886 . . . . 0.0 112.394 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.464 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 43.1 t -97.71 107.13 19.56 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.569 -177.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.928 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.072 179.56 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.487 ' O ' ' HD2' ' A' ' 39' ' ' ARG . . . . . . . . 0 N--CA 1.438 -1.2 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -102.91 164.62 11.51 Favored 'General case' 0 CA--C 1.494 -1.198 0 CA-C-N 117.341 0.57 . . . . 0.0 110.552 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.576 ' HA ' ' O ' ' A' ' 38' ' ' THR . 74.6 m95 -52.57 118.14 3.4 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.2 mm-40 -119.33 112.74 19.81 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 172.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -97.35 145.08 26.48 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.042 -177.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.8 m -93.77 171.68 8.72 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.955 -1.02 . . . . 0.0 108.583 177.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 35.3 m -93.53 155.71 3.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.253 -176.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 38.0 t -69.03 99.98 1.16 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 -176.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.2 p -94.48 132.96 27.75 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.652 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.0 110.94 0.75 Allowed 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.641 2.227 . . . . 0.0 111.728 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 97.0 m -65.95 -23.14 66.54 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.146 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.449 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 12.2 t -133.14 176.56 8.4 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.927 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.47 80.26 0.01 OUTLIER Glycine 0 C--N 1.334 0.454 0 O-C-N 124.006 0.816 . . . . 0.0 113.658 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.9 t70 76.67 -38.99 0.33 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.506 1.122 . . . . 0.0 111.939 175.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 47.4 t -123.66 109.61 13.94 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.934 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.449 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -172.94 154.99 22.0 Favored Glycine 0 CA--C 1.491 -1.42 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 -178.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.5 tp -64.13 108.99 1.69 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 118.224 1.012 . . . . 0.0 109.01 178.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.26 175.31 25.12 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.113 -0.948 . . . . 0.0 114.825 -173.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.84 153.66 50.72 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.694 -0.753 . . . . 0.0 111.395 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -144.15 138.35 28.09 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -115.57 132.01 56.76 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.797 -0.183 . . . . 0.0 111.333 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -131.24 136.22 8.69 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 177.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.576 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 6.9 p -123.89 148.24 46.99 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 121.194 -0.202 . . . . 0.0 111.076 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.556 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 11.2 tpt85 -157.01 160.1 38.67 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.58 146.17 26.38 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.513 175.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -98.72 -150.35 25.78 Favored Glycine 0 C--O 1.217 -0.967 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.84 -36.56 49.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 118.085 0.942 . . . . 0.0 109.681 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 20.6 mm-40 -85.47 -0.52 55.15 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.216 174.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 5.2 m 40.05 60.57 1.7 Allowed 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.749 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 36.2 mmtm -118.28 141.8 48.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.028 0.442 . . . . 0.0 112.038 -178.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.445 ' O ' ' HG3' ' A' ' 48' ' ' MET . 47.9 mt-30 45.22 -108.34 0.15 Allowed 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.082 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.441 ' O ' ' HB3' ' A' ' 39' ' ' ARG . 0.8 OUTLIER 48.32 27.74 1.43 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 178.693 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.445 ' HG3' ' O ' ' A' ' 46' ' ' GLN . 86.9 mtp -113.96 146.12 40.57 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -147.6 137.37 22.76 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.469 0.652 . . . . 0.0 111.78 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.1 p -114.4 138.46 50.54 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 174.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -134.1 151.53 51.42 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-O 121.875 0.845 . . . . 0.0 112.098 -174.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -85.67 139.05 31.7 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 113.677 -1.601 . . . . 0.0 109.144 172.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 52.9 t -117.98 159.24 23.5 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -173.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.5 tttm -114.27 124.88 53.11 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 52.9 mt -101.94 128.47 28.61 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.413 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.78 48.66 2.25 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 123.131 2.554 . . . . 0.0 113.107 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 26.8 p . . . . . 0 C--N 1.317 -0.833 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.712 179.062 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.667 0 N-CA-C 111.992 -0.443 . . . . 0.0 111.992 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.62 -62.87 1.43 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.878 0.37 . . . . 0.0 110.731 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -86.28 -5.15 59.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.131 0.491 . . . . 0.0 110.505 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 62.8 m -65.73 141.01 58.49 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.686 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -116.8 125.39 51.53 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.467 ' HE2' ' HB2' ' A' ' 90' ' ' LEU . 36.5 m-85 -126.41 146.85 49.91 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -173.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.44 ' HB2' ' HE3' ' A' ' 91' ' ' LYS . 64.2 tt0 -126.49 115.73 20.01 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 106.189 -1.782 . . . . 0.0 106.189 170.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -101.29 156.42 17.46 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -173.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 35.3 tt0 -78.66 144.76 35.07 Favored 'General case' 0 N--CA 1.4 -2.971 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 172.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' A' ' 72' ' ' GLN . . . 166.5 120.91 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.288 0.367 . . . . 0.0 110.45 -173.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' TRP . . . . . 0.513 ' CZ3' ' HB2' ' A' ' 76' ' ' GLU . 1.1 p-90 -92.16 -8.66 44.95 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.239 0.542 . . . . 0.0 110.379 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 107.87 -39.32 2.94 Favored Glycine 0 CA--C 1.507 -0.437 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.04 175.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.513 ' HB2' ' CZ3' ' A' ' 74' ' ' TRP . 36.9 mt-10 -95.65 142.6 27.77 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 114.978 -0.611 . . . . 0.0 110.34 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 31.0 p -78.31 171.14 15.51 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 176.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -94.06 121.53 35.64 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.491 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 20.8 mt -72.83 -30.15 63.8 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.14 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -67.45 -33.36 74.98 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 121.321 0.581 . . . . 0.0 110.125 -177.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.723 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 76.8 p -104.27 -9.25 18.72 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.643 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.19 24.64 11.62 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.126 0.97 . . . . 0.0 111.475 -177.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.723 ' HG ' ' O ' ' A' ' 81' ' ' THR . 65.6 mt -131.39 165.08 24.28 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-O 120.961 0.41 . . . . 0.0 110.41 -172.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -119.83 132.71 55.66 Favored 'General case' 0 N--CA 1.414 -2.253 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.2 p -135.14 142.0 46.09 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.027 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.6 mtm180 -139.94 128.49 22.93 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.2 m -99.95 145.34 27.96 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -145.31 149.37 21.49 Favored Glycine 0 N--CA 1.434 -1.478 0 C-N-CA 118.879 -1.629 . . . . 0.0 112.664 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 101' ' ' LYS . 29.1 m -132.12 149.34 52.43 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.103 -0.549 . . . . 0.0 111.015 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.595 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.1 tm? -75.48 122.04 23.25 Favored 'General case' 0 N--CA 1.414 -2.268 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.44 ' HE3' ' HB2' ' A' ' 70' ' ' GLN . 11.4 ptpt -101.26 -15.23 17.36 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -177.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -162.55 130.82 3.97 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.439 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -138.22 144.19 40.5 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.4 mp -91.28 170.54 9.9 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.442 178.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -69.54 -13.42 62.33 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.278 0.561 . . . . 0.0 110.996 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -107.15 29.92 6.67 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.16 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.55 115.95 3.79 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.445 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -87.69 123.46 32.55 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 80.4 m -134.83 139.76 45.32 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.541 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.595 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 1.2 pm0 -70.03 145.18 51.93 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.193 176.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 89' ' ' SER . 36.4 ttpt -72.25 -42.47 65.62 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.225 -176.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.2 t -152.44 148.19 27.15 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 118.512 -1.275 . . . . 0.0 113.019 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.3 m -131.88 149.35 32.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.88 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 11.3 t -114.08 139.61 49.16 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 114.238 -1.346 . . . . 0.0 109.12 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 13.3 mt -131.03 138.31 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.118 0 CA-C-O 120.917 0.389 . . . . 0.0 111.015 -173.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.7 t -130.09 128.9 42.8 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.03 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -136.09 129.32 17.95 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.294 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.84 113.65 3.07 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 121.086 1.19 . . . . 0.0 110.61 175.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 50.7 t -81.3 67.41 7.23 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -175.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.425 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.708 177.72 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.061 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 17' ' ' GLU . 1.8 pm0 -86.91 166.92 14.76 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -50.63 122.04 6.65 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.988 -1.006 . . . . 0.0 112.389 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -103.51 136.73 42.7 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 176.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -120.83 130.89 54.15 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.634 0.73 . . . . 0.0 112.425 -175.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.2 t -94.49 171.82 8.57 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 114.502 -1.226 . . . . 0.0 107.845 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.8 m -92.36 142.67 12.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.042 -178.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.8 t -66.36 132.43 48.32 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.362 -176.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.4 t -93.11 116.35 66.36 Favored Pre-proline 0 C--N 1.311 -1.102 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.513 ' O ' ' HB ' ' A' ' 26' ' ' THR . 19.2 Cg_endo -57.62 -23.96 59.89 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.169 2.579 . . . . 0.0 113.138 -175.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.513 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 55.5 m 83.01 -41.92 0.1 Allowed 'General case' 0 C--O 1.234 0.238 0 C-N-CA 123.209 0.604 . . . . 0.0 111.091 177.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 t 70.41 -146.56 0.08 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.736 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.403 ' O ' ' HB3' ' A' ' 29' ' ' ASP . . . 64.46 51.5 51.73 Favored Glycine 0 CA--C 1.498 -1.029 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -176.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.403 ' HB3' ' O ' ' A' ' 28' ' ' GLY . 20.8 t70 72.92 -57.72 0.62 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.624 0.77 . . . . 0.0 111.146 -178.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 68.1 m -155.21 96.95 1.87 Allowed 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 123.597 0.759 . . . . 0.0 109.043 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.408 ' H ' HD13 ' A' ' 55' ' ' ILE . . . -120.84 145.85 17.39 Favored Glycine 0 N--CA 1.431 -1.682 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.887 -179.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.7 tp -72.39 109.45 6.1 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.71 155.08 52.76 Favored Glycine 0 N--CA 1.438 -1.181 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.14 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.0 p -135.43 152.27 51.22 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.228 0.537 . . . . 0.0 111.306 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -133.49 149.31 51.73 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -130.37 131.11 45.16 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 120.723 0.297 . . . . 0.0 110.917 -178.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -123.07 144.72 15.86 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 109.771 -1.331 . . . . 0.0 109.771 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 28.2 p -134.91 153.94 51.87 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 117.429 0.615 . . . . 0.0 111.65 -177.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.444 ' HG2' ' N ' ' A' ' 40' ' ' THR . 22.6 ttt180 -149.53 161.35 42.3 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.511 ' HB ' ' HA ' ' A' ' 44' ' ' CYS . 1.3 p -104.95 154.42 20.12 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 177.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -87.35 -166.53 42.61 Favored Glycine 0 CA--C 1.507 -0.423 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.79 -23.33 58.49 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 118.46 1.13 . . . . 0.0 108.911 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.428 ' HG3' ' HG2' ' A' ' 45' ' ' LYS . 6.7 pt-20 -94.86 7.79 44.81 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.495 -1.23 . . . . 0.0 109.587 176.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.511 ' HA ' ' HB ' ' A' ' 40' ' ' THR . 93.7 m 65.08 30.32 11.67 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.996 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 40' ' ' THR . 32.8 mmtp -80.05 -178.34 6.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.668 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -96.2 109.21 21.71 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.976 0.417 . . . . 0.0 111.904 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -109.43 126.38 53.41 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 175.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 27.3 ttt -137.02 153.25 50.69 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -173.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -144.8 135.15 24.27 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.242 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.5 m -116.98 139.04 51.14 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -134.72 152.13 51.52 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.797 0.332 . . . . 0.0 110.6 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.444 ' N ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -105.41 130.91 53.4 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.156 179.249 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 58.1 m -87.91 -168.52 2.24 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 39.3 tttp -124.51 131.47 53.49 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.408 HD13 ' H ' ' A' ' 31' ' ' GLY . 20.1 tt -106.45 118.14 55.36 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 121.014 0.435 . . . . 0.0 110.544 -179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.28 -29.12 3.27 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.579 2.186 . . . . 0.0 112.91 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 62.1 m . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 122.849 0.459 . . . . 0.0 112.05 179.651 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.786 0 N-CA-C 112.153 -0.379 . . . . 0.0 112.153 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -129.65 -62.03 0.98 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.056 0.455 . . . . 0.0 110.382 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -83.69 -15.14 49.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.589 0.709 . . . . 0.0 109.525 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 9.9 p -153.81 -166.14 2.31 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 114.981 -1.009 . . . . 0.0 108.469 -177.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -132.01 147.36 52.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.481 ' CE2' HD23 ' A' ' 90' ' ' LEU . 48.5 m-85 -118.35 151.55 37.52 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-O 121.18 0.514 . . . . 0.0 111.899 -177.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.462 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 48.8 tp60 -114.76 117.66 31.39 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.033 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -96.58 141.55 29.71 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -119.03 162.39 18.64 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.099 0.476 . . . . 0.0 109.851 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.3 156.76 44.4 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.156 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -103.99 -11.53 17.36 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 165.12 -147.45 12.53 Favored Glycine 0 N--CA 1.428 -1.839 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -117.52 113.87 22.62 Favored 'General case' 0 N--CA 1.427 -1.589 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.869 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 14.9 t 60.77 118.25 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 O-C-N 124.049 0.843 . . . . 0.0 111.633 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -68.82 109.97 4.13 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.9 mt -69.33 -22.29 63.77 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.691 -174.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -66.69 -39.77 88.25 Favored 'General case' 0 N--CA 1.425 -1.675 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.203 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.8 p -107.82 -14.71 14.72 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 69.54 27.17 4.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 122.136 0.97 . . . . 0.0 108.998 -178.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.471 HD22 ' HA ' ' A' ' 108' ' ' PRO . 22.6 mt -127.71 167.44 16.45 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-N 114.218 -1.356 . . . . 0.0 107.978 -178.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.545 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 27.7 ttpt -121.84 136.48 54.93 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.762 -177.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.6 m -120.1 145.33 47.0 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 115.175 -0.921 . . . . 0.0 111.565 -175.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -130.32 129.34 43.07 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 176.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.07 138.57 48.55 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.7 152.58 23.14 Favored Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.066 -178.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 23.0 t -145.66 146.02 31.14 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.026 0.441 . . . . 0.0 110.703 -179.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.0 tm? -68.11 123.06 19.61 Favored 'General case' 0 N--CA 1.406 -2.632 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.492 176.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.462 ' HD3' ' HB2' ' A' ' 70' ' ' GLN . 59.6 mtmt -85.75 -48.18 9.05 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 120.905 0.383 . . . . 0.0 110.715 -178.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -161.67 144.44 12.03 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.047 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -132.99 151.78 52.03 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.429 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tp -83.18 169.85 15.35 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -65.5 -27.4 68.45 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.586 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -105.13 45.74 0.95 Allowed 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.555 0.693 . . . . 0.0 109.41 177.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -150.34 115.16 5.28 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.059 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -103.37 117.24 34.03 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.563 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . 0.453 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 83.8 m -141.05 145.9 36.48 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.068 0.461 . . . . 0.0 111.582 -178.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.61 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 20.1 pm0 -66.76 150.08 49.63 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.377 175.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -76.72 -36.53 57.11 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.198 -173.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . 0.45 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 5.4 t -152.57 149.53 28.58 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 119.296 -0.961 . . . . 0.0 113.378 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 17.0 m -136.39 140.64 43.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.94 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 11.0 t -128.85 136.69 50.81 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.507 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 12.9 tt -140.33 140.69 34.29 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 121.159 0.504 . . . . 0.0 111.249 -178.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 18.6 m -120.43 128.46 53.21 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.018 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -131.32 115.78 16.3 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.394 -179.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.471 ' HA ' HD22 ' A' ' 83' ' ' LEU . 77.0 Cg_exo -51.26 127.63 22.73 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.524 2.149 . . . . 0.0 112.078 178.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.545 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 86.0 m -65.68 -50.22 65.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.806 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.224 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.666 179.191 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.591 ' N ' ' HG1' ' A' ' 40' ' ' THR . . . . . . . . 0 N--CA 1.445 -0.75 0 CA-C-O 121.041 0.245 . . . . 0.0 113.067 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.57 ' CD ' ' H ' ' A' ' 17' ' ' GLU . 1.4 pm0 -85.45 170.66 12.46 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 123.791 0.836 . . . . 0.0 111.438 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.541 ' HA ' ' O ' ' A' ' 38' ' ' THR . 66.1 m95 -46.77 119.86 2.69 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.692 0.758 . . . . 0.0 112.888 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 93.5 mt-30 -116.1 115.12 25.5 Favored 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 175.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -101.13 146.55 27.33 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -175.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.0 t -91.98 174.98 7.04 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 114.53 -1.213 . . . . 0.0 109.334 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.9 m -93.13 153.46 3.33 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.325 -175.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.437 ' SG ' ' HD3' ' A' ' 35' ' ' ARG . 34.0 m -84.23 112.04 19.92 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.785 -176.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.48 ' O ' ' HA3' ' A' ' 33' ' ' GLY . 6.9 m -106.86 102.76 44.15 Favored Pre-proline 0 N--CA 1.435 -1.201 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 174.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.544 ' O ' ' HB ' ' A' ' 26' ' ' THR . 26.3 Cg_endo -62.18 -16.55 51.43 Favored 'Trans proline' 0 C--O 1.218 -0.484 0 C-N-CA 122.839 2.359 . . . . 0.0 112.553 -176.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.544 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 51.9 m 81.62 -14.53 0.79 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 122.544 1.164 . . . . 0.0 108.875 177.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.503 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 16.7 t -142.37 -145.46 0.17 Allowed 'General case' 0 N--CA 1.411 -2.414 0 CA-C-N 113.767 -1.561 . . . . 0.0 109.113 -178.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -151.93 -42.25 0.02 OUTLIER Glycine 0 CA--C 1.482 -2.023 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -102.98 66.54 0.92 Allowed 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.38 0.61 . . . . 0.0 110.797 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.2 m 75.29 76.43 0.1 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.463 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.503 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -127.89 154.94 19.98 Favored Glycine 0 N--CA 1.44 -1.04 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 177.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.469 HD21 HH11 ' A' ' 52' ' ' ARG . 55.7 tp -83.76 125.42 31.89 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.739 0.269 . . . . 0.0 110.893 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.48 ' HA3' ' O ' ' A' ' 24' ' ' VAL . . . -139.17 164.74 25.83 Favored Glycine 0 CA--C 1.505 -0.564 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 -177.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 6.8 m -145.69 154.92 42.62 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -174.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.437 ' HD3' ' SG ' ' A' ' 23' ' ' CYS . 23.5 ptt180 -134.9 154.32 51.72 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.759 176.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.444 ' HG2' HG22 ' A' ' 50' ' ' THR . 25.3 mt-10 -115.96 131.72 56.86 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.148 -177.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -122.46 151.07 16.89 Favored Glycine 0 CA--C 1.52 0.357 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.541 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 14.2 p -134.32 155.03 50.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.429 0.614 . . . . 0.0 111.471 -177.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.539 ' HG2' ' N ' ' A' ' 40' ' ' THR . 17.5 ttt180 -151.49 160.47 43.69 Favored 'General case' 0 C--O 1.217 -0.609 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.596 HG22 ' HA ' ' A' ' 44' ' ' CYS . 0.2 OUTLIER -133.71 155.34 49.92 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 174.908 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -106.39 -152.11 19.35 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 111.095 -0.802 . . . . 0.0 111.095 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.58 -33.63 53.86 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 117.062 0.431 . . . . 0.0 111.649 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -84.94 1.68 46.25 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -177.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.596 ' HA ' HG22 ' A' ' 40' ' ' THR . 66.4 m 57.78 32.87 22.52 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.873 0.368 . . . . 0.0 111.422 -178.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -68.36 -23.54 64.7 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.312 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 72.25 105.46 0.07 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.635 0.731 . . . . 0.0 112.278 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 m -105.15 145.11 31.02 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.269 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 26.0 ttt -139.54 148.25 42.34 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.555 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -143.35 136.34 27.78 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.444 HG22 ' HG2' ' A' ' 36' ' ' GLU . 13.0 p -116.62 135.9 53.41 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 55.7 tp60 -137.86 138.24 38.9 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 120.364 -0.535 . . . . 0.0 111.386 -177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.469 HH11 HD21 ' A' ' 32' ' ' LEU . 39.6 mtt180 -87.37 131.5 34.26 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 85.4 m -82.36 160.64 22.77 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -113.69 135.38 54.0 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-O 121.259 0.552 . . . . 0.0 112.113 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 31' ' ' GLY . 4.0 mp -111.16 126.22 29.08 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.751 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -70.08 103.18 1.18 Allowed 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.487 2.125 . . . . 0.0 111.349 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 4.6 t . . . . . 0 C--N 1.316 -0.89 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.213 -177.977 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.891 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.5 -32.88 74.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.625 0.25 . . . . 0.0 111.625 -178.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -84.76 -13.4 51.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.968 0.413 . . . . 0.0 111.027 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 82.0 m -81.91 158.86 23.8 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.704 ' O ' ' HA ' ' A' ' 90' ' ' LEU . 47.6 mtpt -128.19 127.68 43.37 Favored 'General case' 0 CA--C 1.498 -1.025 0 C-N-CA 119.631 -0.828 . . . . 0.0 110.896 -176.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 100' ' ' GLN . 79.0 m-85 -124.8 129.33 50.24 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.894 -175.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -112.07 129.75 56.11 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -94.14 135.7 35.24 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.979 0.419 . . . . 0.0 110.924 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.444 HE21 ' HB ' ' A' ' 87' ' ' THR . 7.1 pt20 -108.19 162.97 13.58 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.916 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.65 92.27 3.22 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.713 -177.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 43.0 p-90 -92.45 -18.07 23.71 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.525 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -167.27 110.77 0.41 Allowed Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.991 -0.843 . . . . 0.0 110.991 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -95.53 115.84 28.0 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-O 120.792 0.329 . . . . 0.0 111.774 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.622 ' H ' ' HG3' ' A' ' 84' ' ' LYS . 13.5 t 60.76 107.72 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.744 -1.116 . . . . 0.0 112.428 175.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.55 ' OD2' HG22 ' A' ' 81' ' ' THR . 27.3 t70 -82.16 131.16 35.24 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.789 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.8 mt -72.39 -32.41 66.37 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.559 -176.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -69.13 -42.42 76.04 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.288 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.568 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 10.0 t -105.99 -1.61 23.79 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -175.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 55.06 32.47 18.32 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -178.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 81' ' ' THR . 24.0 mt -127.1 164.33 21.82 Favored 'General case' 0 CA--C 1.497 -1.081 0 O-C-N 121.845 -0.535 . . . . 0.0 110.143 -178.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.622 ' HG3' ' H ' ' A' ' 77' ' ' CYS . 77.5 tttt -120.64 136.68 54.76 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -177.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 4.2 m -119.35 144.24 46.97 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.567 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -139.48 141.19 37.4 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.089 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.444 ' HB ' HE21 ' A' ' 72' ' ' GLN . 14.2 m -120.93 145.5 47.63 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.091 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -144.55 157.16 27.14 Favored Glycine 0 N--CA 1.443 -0.849 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.9 m -145.61 149.64 34.89 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.62 0.21 . . . . 0.0 111.206 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.768 HD12 ' HA ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -69.46 129.97 41.2 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.003 0.43 . . . . 0.0 110.219 177.595 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -92.65 -32.72 14.65 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 120.906 0.384 . . . . 0.0 110.91 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.94 143.93 31.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -134.65 145.46 48.6 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.71 0.291 . . . . 0.0 110.822 -176.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.7 mp -91.4 174.73 7.22 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.233 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -88.95 -17.25 29.88 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.105 0.478 . . . . 0.0 110.833 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -101.86 28.03 6.03 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.274 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -164.01 117.79 1.47 Allowed 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.983 -176.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -82.03 111.27 18.03 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 174.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 80.4 m -94.3 165.21 12.7 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.37 0.605 . . . . 0.0 112.262 -175.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.497 ' O ' ' HB3' ' A' ' 90' ' ' LEU . 88.4 mt-30 -87.04 124.62 33.41 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.251 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.768 ' HA ' HD12 ' A' ' 90' ' ' LEU . 20.1 pttm -74.79 -31.96 61.88 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.412 -178.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.9 t -158.88 149.22 19.63 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-O 121.463 0.649 . . . . 0.0 111.389 175.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 13.7 m -141.5 139.47 32.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.063 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.5 m -129.04 131.67 47.38 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.108 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 22.4 pt -135.47 145.63 31.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 CA-C-O 120.625 0.25 . . . . 0.0 110.453 -177.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 84' ' ' LYS . 6.5 p -122.55 134.38 54.54 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.872 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -126.03 132.32 24.27 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.888 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.42 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 30.8 Cg_endo -64.03 124.47 13.56 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.049 1.833 . . . . 0.0 112.233 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 94.9 m -73.12 -17.85 61.35 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.235 0.541 . . . . 0.0 109.822 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.536 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 178.083 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.031 0 N-CA-C 112.034 -0.426 . . . . 0.0 112.034 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -107.83 164.55 12.15 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -56.98 123.55 15.54 Favored 'General case' 0 N--CA 1.427 -1.592 0 O-C-N 123.528 0.518 . . . . 0.0 111.109 173.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.571 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 74.3 mt-30 -115.95 115.45 26.19 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -104.26 143.61 32.73 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 t -104.38 171.59 7.25 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.87 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.8 m -94.61 154.82 3.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.6 t -56.16 114.15 1.84 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.325 -178.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 10.5 m -109.99 120.81 43.63 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.989 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.97 129.58 19.87 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 122.786 2.324 . . . . 0.0 113.731 -177.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.485 ' HB ' ' O ' ' A' ' 32' ' ' LEU . 94.9 m -77.75 -22.51 50.17 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.227 176.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.585 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 17.9 t -159.71 116.91 2.62 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.65 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.9 -32.73 80.79 Favored Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.746 -0.661 . . . . 0.0 113.088 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -76.38 52.68 0.79 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.566 0.222 . . . . 0.0 111.371 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.491 ' HA ' HD13 ' A' ' 55' ' ' ILE . 42.5 t 65.95 80.98 0.21 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.141 179.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.585 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -148.87 157.11 27.14 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.3 -0.952 . . . . 0.0 114.191 -177.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.485 ' O ' ' HB ' ' A' ' 26' ' ' THR . 4.3 mm? -49.26 158.42 0.38 Allowed 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 124.465 1.106 . . . . 0.0 112.459 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.1 176.71 19.85 Favored Glycine 0 N--CA 1.434 -1.496 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -178.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.4 p -140.35 156.19 46.51 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 118.24 1.02 . . . . 0.0 113.049 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 70.9 mtt-85 -135.62 138.47 42.94 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.749 -1.114 . . . . 0.0 108.542 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -124.85 131.31 53.45 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 120.858 0.361 . . . . 0.0 111.583 -177.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.571 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -133.42 137.33 9.27 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.6 p -132.04 152.8 50.96 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 117.439 0.619 . . . . 0.0 111.083 -177.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.41 ' HG2' ' N ' ' A' ' 40' ' ' THR . 68.7 ttt180 -155.17 160.77 41.16 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.41 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 6.2 p -117.88 161.85 19.08 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.42 ' H ' ' N ' ' A' ' 45' ' ' LYS . . . -81.11 -173.03 47.15 Favored Glycine 0 C--N 1.322 -0.248 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.222 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.79 -33.47 72.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.983 0.42 . . . . 0.0 110.983 -178.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -97.7 18.12 16.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.497 0.665 . . . . 0.0 109.414 176.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 72.4 m 69.06 60.04 0.34 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.954 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.469 ' HG3' ' H ' ' A' ' 46' ' ' GLN . 14.4 tptm -77.6 -145.87 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.814 176.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.469 ' H ' ' HG3' ' A' ' 45' ' ' LYS . 52.2 tt0 -150.1 116.09 5.64 Favored 'General case' 0 N--CA 1.412 -2.342 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 -178.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.0 m -133.47 122.18 23.28 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 57.0 mtm -129.0 134.97 48.36 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.912 0.387 . . . . 0.0 111.114 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -132.25 130.33 40.79 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.541 177.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 p -130.8 131.3 44.58 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 176.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -124.93 141.97 51.77 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 121.105 0.478 . . . . 0.0 110.231 -176.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -85.45 110.72 19.37 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 122.451 1.12 . . . . 0.0 112.232 -177.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.2 t -68.66 147.23 52.18 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 113.063 -1.88 . . . . 0.0 109.867 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.0 tttm -114.07 142.14 46.57 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-O 120.753 0.311 . . . . 0.0 110.552 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.491 HD13 ' HA ' ' A' ' 30' ' ' CYS . 17.9 tt -97.91 130.89 27.76 Favored Pre-proline 0 C--N 1.308 -1.197 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -51.0 -52.65 8.64 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.974 2.449 . . . . 0.0 112.242 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 6.3 t . . . . . 0 CA--C 1.536 0.44 0 O-C-N 123.764 0.665 . . . . 0.0 110.886 179.435 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.455 0 N-CA-C 112.634 -0.186 . . . . 0.0 112.634 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 62.55 15.69 8.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.047 0.539 . . . . 0.0 111.719 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -84.25 -5.63 59.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.363 0.601 . . . . 0.0 110.293 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 50.0 m -136.52 -160.68 1.08 Allowed 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -127.11 137.05 52.92 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.047 0.385 . . . . 0.0 110.134 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -123.26 150.24 43.75 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.995 -178.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.9 tm0? -125.51 125.43 43.25 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -94.18 131.43 39.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.199 0.523 . . . . 0.0 112.141 -176.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -97.25 163.79 12.76 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.84 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -126.66 79.32 1.86 Allowed 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.109 -178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 42.2 t-105 -82.32 -26.31 33.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.238 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -143.78 157.14 26.95 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.574 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -96.32 147.92 23.3 Favored 'General case' 0 N--CA 1.437 -1.113 0 C-N-CA 123.167 0.587 . . . . 0.0 110.15 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 40.5 t -30.63 137.38 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 O-C-N 124.203 0.939 . . . . 0.0 111.428 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -77.85 122.04 24.92 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 121.516 0.674 . . . . 0.0 109.841 -176.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.8 mt -70.7 -33.12 70.55 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 114.609 -1.178 . . . . 0.0 112.091 -173.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -71.67 -37.49 70.76 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.496 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.513 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 68.1 p -104.32 -8.01 19.57 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -172.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 57.27 34.5 24.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.275 0.56 . . . . 0.0 110.528 -175.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 81' ' ' THR . 44.1 mt -126.98 147.3 50.12 Favored 'General case' 0 CA--C 1.496 -1.11 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.094 -178.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.752 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 81.4 tttt -124.77 137.26 54.33 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.703 -178.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 52.3 m -119.12 143.76 47.0 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 -134.73 140.55 46.03 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.0 m -109.81 143.72 39.26 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -136.39 167.28 24.52 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 120.462 -0.875 . . . . 0.0 111.393 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.8 p -135.22 144.28 46.83 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 120.626 0.25 . . . . 0.0 110.7 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.599 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 2.9 tm? -70.76 122.87 20.66 Favored 'General case' 0 N--CA 1.409 -2.492 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -97.35 -37.54 9.99 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.957 0.408 . . . . 0.0 110.853 -177.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -155.64 135.06 12.4 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.234 178.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -126.18 144.78 50.63 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 42.9 mt -87.24 174.39 8.62 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.394 0.616 . . . . 0.0 111.535 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -73.64 -26.7 60.89 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.48 -178.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -105.05 35.94 2.64 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.613 0.72 . . . . 0.0 109.495 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -154.11 134.57 13.47 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.921 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -112.31 122.46 47.79 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 70.7 m -139.72 141.31 36.92 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.205 0.526 . . . . 0.0 111.599 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.599 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 3.0 pm0 -68.72 154.27 42.26 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.81 176.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.4 pttm -74.07 -26.55 60.45 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.555 -175.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.5 t -140.63 150.95 44.2 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.324 -0.55 . . . . 0.0 111.665 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 15.8 m -138.87 149.48 23.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.24 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 97.2 m -129.24 136.61 50.33 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.42 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tt -140.7 141.31 32.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 120.84 0.352 . . . . 0.0 110.614 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 57.6 m -121.16 134.8 55.23 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -134.27 133.94 22.24 Favored Pre-proline 0 C--N 1.313 -0.983 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.429 -178.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.43 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 32.7 Cg_exo -58.12 131.03 40.93 Favored 'Trans proline' 0 C--O 1.244 0.777 0 C-N-CA 121.924 1.75 . . . . 0.0 111.504 175.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.752 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 69.8 m -81.77 173.55 12.18 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.325 0.583 . . . . 0.0 111.576 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.151 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 -179.561 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.755 0 CA-C-O 120.855 0.142 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -76.2 169.66 17.79 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 122.93 0.492 . . . . 0.0 111.253 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.522 ' HA ' ' O ' ' A' ' 38' ' ' THR . 81.6 m95 -48.57 118.93 2.75 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.417 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.453 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 6.8 pt20 -120.14 115.44 23.66 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 89.7 m95 -100.8 146.41 27.32 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.803 -175.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 m -94.53 171.8 8.58 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 114.79 -1.095 . . . . 0.0 108.998 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.5 m -91.93 154.79 3.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -177.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.8 t -74.45 116.47 15.16 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.805 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.0 t -111.44 117.87 48.39 Favored Pre-proline 0 N--CA 1.434 -1.246 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 179.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.32 143.66 75.26 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.533 2.155 . . . . 0.0 112.373 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.436 ' HB ' ' O ' ' A' ' 32' ' ' LEU . 23.7 m -90.3 -23.8 21.06 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.354 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.4 t -134.62 173.63 11.45 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.074 179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.94 74.57 0.25 Allowed Glycine 0 N--CA 1.448 -0.565 0 O-C-N 123.683 0.614 . . . . 0.0 113.617 -177.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.7 t70 68.93 23.87 6.56 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-O 121.9 0.857 . . . . 0.0 110.826 174.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.502 ' HA ' ' HB2' ' A' ' 57' ' ' CYS . 9.0 t -150.92 10.35 0.61 Allowed 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.619 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.482 ' O ' HG13 ' A' ' 55' ' ' ILE . . . -126.51 126.1 5.62 Favored Glycine 0 CA--C 1.494 -1.229 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.539 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 53' ' ' CYS . 1.2 mp -51.64 152.4 2.81 Favored 'General case' 0 C--O 1.207 -1.158 0 O-C-N 124.176 0.574 . . . . 0.0 111.483 -179.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.07 -175.19 14.79 Favored Glycine 0 CA--C 1.496 -1.154 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 -173.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.2 p -136.8 154.14 50.62 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 117.816 0.808 . . . . 0.0 112.207 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -126.23 137.63 53.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 175.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -113.9 131.41 56.3 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.569 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.453 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -137.7 141.7 12.51 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.522 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 22.8 p -123.79 154.78 39.06 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.954 0.377 . . . . 0.0 110.658 -179.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.522 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 9.4 tpt180 -145.18 159.95 42.21 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.403 ' OG1' ' HA ' ' A' ' 44' ' ' CYS . 11.1 t -115.84 162.22 17.63 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-O 122.173 0.987 . . . . 0.0 112.225 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.41 -164.15 11.23 Favored Glycine 0 C--N 1.286 -2.24 0 CA-C-N 113.432 -1.713 . . . . 0.0 108.839 175.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.17 -25.97 66.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 118.254 1.027 . . . . 0.0 111.872 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -99.73 -11.34 20.94 Favored 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 120.182 -0.607 . . . . 0.0 111.364 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.403 ' HA ' ' OG1' ' A' ' 40' ' ' THR . 93.8 m 68.29 152.17 0.09 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptp 63.25 10.8 4.9 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.832 175.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -103.57 18.12 22.57 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.42 ' HB ' ' O ' ' A' ' 39' ' ' ARG . 11.9 m -143.62 110.44 5.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.549 0.69 . . . . 0.0 112.01 178.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 24.2 ttt -146.23 135.11 22.46 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.045 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -143.05 142.76 31.64 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.12 0.486 . . . . 0.0 111.397 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.1 m -118.4 136.58 53.68 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.08 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -128.73 141.19 51.4 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 110.264 -0.272 . . . . 0.0 110.264 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 84.1 mtt180 -86.91 139.49 30.58 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.441 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 1.5 p -99.96 -170.18 1.85 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -113.49 138.42 50.15 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.655 0.264 . . . . 0.0 110.75 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 31' ' ' GLY . 22.0 mm -126.69 111.15 22.63 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.273 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.76 122.92 9.59 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.569 2.179 . . . . 0.0 111.411 177.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.502 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 42.6 t . . . . . 0 C--N 1.322 -0.604 0 CA-C-O 120.663 0.268 . . . . 0.0 110.986 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.727 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.06 -56.89 2.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.017 0.436 . . . . 0.0 110.596 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -89.17 -19.72 25.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.879 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 99.0 m -80.72 116.52 20.77 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.539 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -112.98 130.33 56.17 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.696 ' CE1' HD23 ' A' ' 90' ' ' LEU . 4.6 m-85 -106.58 152.36 23.82 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.374 -177.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.447 ' O ' ' HA2' ' A' ' 88' ' ' GLY . 6.4 tp-100 -103.34 117.05 33.61 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 174.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -94.52 118.74 32.14 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -175.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -122.34 162.97 20.55 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.373 177.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.52 141.63 28.47 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-O 120.972 0.415 . . . . 0.0 111.037 -176.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 40.6 t-105 -97.65 -5.3 35.67 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 148.85 -170.57 29.25 Favored Glycine 0 N--CA 1.427 -1.94 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.873 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -95.68 148.48 22.5 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 124.04 0.936 . . . . 0.0 109.09 179.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 13.8 m -22.98 125.18 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.358 0 O-C-N 124.225 0.953 . . . . 0.0 112.447 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -80.33 120.46 24.41 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.1 mt -70.22 -28.33 65.18 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.304 -0.862 . . . . 0.0 112.302 -174.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -70.7 -37.38 73.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.029 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.611 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.5 p -105.37 -9.41 17.59 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -174.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.98 25.72 14.16 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.422 0.689 . . . . 0.0 110.972 -175.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 81' ' ' THR . 13.9 mt -126.86 162.41 25.95 Favored 'General case' 0 CA--C 1.5 -0.968 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.49 -177.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.623 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 34.9 ttpt -118.93 147.84 43.59 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.1 m -119.27 142.48 48.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.841 0.353 . . . . 0.0 110.479 -176.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.0 tpt180 -135.22 141.03 45.73 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -178.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.7 m -118.43 144.69 45.78 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.486 -178.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.447 ' HA2' ' O ' ' A' ' 70' ' ' GLN . . . -136.29 150.28 20.4 Favored Glycine 0 N--CA 1.435 -1.379 0 C-N-CA 120.195 -1.002 . . . . 0.0 111.938 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 25.8 m -127.36 134.29 49.97 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 120.981 0.419 . . . . 0.0 111.903 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.696 HD23 ' CE1' ' A' ' 69' ' ' TYR . 2.8 tm? -74.4 127.49 33.16 Favored 'General case' 0 N--CA 1.427 -1.62 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.235 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -86.77 -50.75 6.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.567 -177.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -144.08 142.02 30.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.83 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.526 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -135.18 140.02 45.02 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.7 mp -89.12 175.92 7.18 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 120.915 0.388 . . . . 0.0 110.582 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -83.23 0.52 45.16 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.909 0.385 . . . . 0.0 111.578 -176.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -101.19 15.14 29.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.162 0.506 . . . . 0.0 110.339 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -173.9 123.64 0.34 Allowed 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.04 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -93.58 110.14 21.75 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.331 0.586 . . . . 0.0 109.654 177.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 75.7 m -109.91 133.05 53.59 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.114 -177.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -66.96 150.81 48.71 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.01 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -74.82 -29.63 61.13 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.939 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.7 t -146.05 150.06 35.27 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.766 0.793 . . . . 0.0 112.263 178.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 28.7 m -135.49 146.87 29.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.316 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 95.8 m -128.43 127.68 43.0 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 13.5 tt -136.02 148.62 27.65 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 CA-C-O 120.818 0.342 . . . . 0.0 110.611 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 84' ' ' LYS . 54.6 m -130.3 135.68 48.34 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.097 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -133.26 148.59 69.68 Favored Pre-proline 0 C--N 1.319 -0.745 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.876 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.488 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 34.4 Cg_exo -59.63 131.98 43.16 Favored 'Trans proline' 0 CA--C 1.516 -0.408 0 C-N-CA 122.63 2.22 . . . . 0.0 113.022 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.623 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 78.8 m -75.31 -17.02 60.37 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.349 0.595 . . . . 0.0 109.938 176.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.105 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 177.022 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.616 ' N ' ' HG1' ' A' ' 40' ' ' THR . . . . . . . . 0 N--CA 1.441 -0.997 0 CA-C-O 121.392 0.44 . . . . 0.0 114.115 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -73.97 167.95 20.48 Favored 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 123.915 0.886 . . . . 0.0 111.816 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -49.4 125.14 10.52 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 114.648 -1.16 . . . . 0.0 112.159 178.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -115.5 123.06 47.57 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -102.83 133.11 48.45 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.167 0.508 . . . . 0.0 111.781 -175.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.9 p -96.11 170.09 9.51 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.654 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.3 m -87.23 131.01 36.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 122.494 1.14 . . . . 0.0 111.555 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 35' ' ' ARG . 50.9 t -81.15 135.85 35.83 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 112.947 -1.933 . . . . 0.0 112.779 -175.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.496 ' O ' ' HA3' ' A' ' 33' ' ' GLY . 57.5 t -100.44 100.65 12.59 Favored Pre-proline 0 N--CA 1.438 -1.054 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 171.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.564 ' O ' ' HB ' ' A' ' 26' ' ' THR . 72.3 Cg_endo -74.89 0.92 8.25 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.782 2.321 . . . . 0.0 113.361 -174.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.564 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 17.0 m 80.9 -39.09 0.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.794 0.438 . . . . 0.0 110.611 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.1 t 75.21 179.56 0.19 Allowed 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.616 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.21 8.05 48.15 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.023 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 64.09 10.01 5.1 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.428 0.691 . . . . 0.0 111.577 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 59.2 m -159.14 30.55 0.21 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -109.14 140.11 15.52 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 119.898 -1.144 . . . . 0.0 113.443 -174.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.463 HD12 ' O ' ' A' ' 53' ' ' CYS . 47.6 tp -100.52 127.04 47.0 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 176.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.496 ' HA3' ' O ' ' A' ' 24' ' ' VAL . . . -126.7 -173.49 13.55 Favored Glycine 0 C--N 1.316 -0.544 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.416 HG22 ' HG2' ' A' ' 52' ' ' ARG . 1.3 p -137.02 153.32 50.67 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 118.893 1.346 . . . . 0.0 112.986 -178.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.479 ' HB2' ' HB2' ' A' ' 23' ' ' CYS . 45.3 ttm180 -131.57 137.91 48.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.614 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.438 ' HG2' HG22 ' A' ' 50' ' ' THR . 42.9 mt-10 -115.35 130.41 56.89 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 120.679 0.276 . . . . 0.0 111.029 -178.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -127.88 135.71 8.82 Favored Glycine 0 N--CA 1.435 -1.405 0 N-CA-C 109.038 -1.625 . . . . 0.0 109.038 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 29.8 m -129.06 148.48 51.01 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 117.964 0.882 . . . . 0.0 110.361 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -142.63 162.03 36.53 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.616 ' HG1' ' N ' ' A' ' 16' ' ' GLY . 0.6 OUTLIER -142.78 145.21 33.03 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 175.348 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -101.65 -158.52 26.73 Favored Glycine 0 N--CA 1.437 -1.235 0 C-N-CA 120.069 -1.062 . . . . 0.0 112.155 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.18 -31.54 72.01 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.15 0.5 . . . . 0.0 110.325 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.5 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 27.9 mm-40 -89.49 2.45 54.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.831 178.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 35.89 59.37 0.88 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -174.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 74.5 mmtt -128.62 143.43 50.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.884 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.513 ' HG3' ' H ' ' A' ' 47' ' ' THR . 18.7 pt20 36.02 -108.7 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.575 1.15 . . . . 0.0 113.886 -178.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.513 ' H ' ' HG3' ' A' ' 46' ' ' GLN . 3.0 p 46.35 45.59 13.4 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.891 0.876 . . . . 0.0 113.189 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -125.48 138.34 53.99 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.808 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -136.18 143.75 44.6 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 121.011 0.434 . . . . 0.0 110.385 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.438 HG22 ' HG2' ' A' ' 36' ' ' GLU . 16.6 p -117.65 137.46 52.63 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 66.5 mm-40 -122.24 151.81 40.67 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -177.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HG2' HG22 ' A' ' 34' ' ' THR . 83.8 mtm180 -107.92 126.98 53.33 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 176.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.463 ' O ' HD12 ' A' ' 32' ' ' LEU . 36.3 m -88.32 125.23 34.58 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -111.85 138.87 47.87 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 121.124 0.488 . . . . 0.0 112.041 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.1 mm -114.19 106.05 53.43 Favored Pre-proline 0 N--CA 1.436 -1.148 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -64.67 100.44 0.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.187 1.924 . . . . 0.0 111.358 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.8 t . . . . . 0 C--N 1.32 -0.71 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.897 -178.261 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.578 ' HA3' ' CG ' ' A' ' 69' ' ' TYR . . . . . . . . 0 N--CA 1.449 -0.498 0 N-CA-C 112.643 -0.183 . . . . 0.0 112.643 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.71 -13.51 48.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 0.0 110.743 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -88.96 -5.26 58.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.397 0.618 . . . . 0.0 109.706 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 10.1 p -147.44 -118.08 0.07 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.703 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 92' ' ' ARG . 62.9 mttp -133.38 125.9 30.13 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 122.204 -0.31 . . . . 0.0 110.453 178.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.578 ' CG ' ' HA3' ' A' ' 64' ' ' GLY . 0.3 OUTLIER -130.94 152.9 49.76 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.174 0.511 . . . . 0.0 111.877 -175.997 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -103.27 118.43 36.76 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.22 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -97.6 114.62 26.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -175.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.422 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 6.6 tt0 -123.63 136.83 54.72 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.636 175.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 57.08 36.32 27.5 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.545 0.688 . . . . 0.0 111.179 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -86.62 -23.9 25.54 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.718 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.03 -88.36 0.08 OUTLIER Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 116.054 1.181 . . . . 0.0 116.054 -175.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -117.47 143.88 45.59 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -169.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 8.4 t -69.8 159.32 33.81 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.759 175.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -94.32 115.91 28.2 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-O 121.354 0.597 . . . . 0.0 111.108 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.501 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.6 pt? -71.16 -30.61 66.66 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.958 -178.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -66.9 -33.26 75.2 Favored 'General case' 0 CA--C 1.496 -1.113 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.165 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.502 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 67.8 p -107.72 -8.33 16.11 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.045 -177.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.426 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 59.1 38.3 23.91 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.419 -175.136 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 81' ' ' THR . 81.0 mt -130.02 148.84 51.92 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.488 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.767 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 60.6 tttp -127.05 135.53 50.92 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.649 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -139.37 145.78 39.41 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.71 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -136.44 130.06 32.08 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.896 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.422 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 4.0 m -120.87 143.69 48.78 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.309 -179.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -149.84 152.34 24.28 Favored Glycine 0 N--CA 1.436 -1.356 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.899 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.8 m -146.12 144.19 29.83 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.379 -0.411 . . . . 0.0 111.58 177.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.677 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 4.9 tt -72.26 122.45 21.12 Favored 'General case' 0 N--CA 1.432 -1.365 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 176.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.469 ' HE2' ' O ' ' A' ' 69' ' ' TYR . 46.1 pttt -104.93 -12.58 16.15 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -178.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.575 ' HB2' ' HB2' ' A' ' 68' ' ' LYS . 21.2 mmt180 -150.94 134.19 16.12 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -111.17 132.64 54.15 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.411 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.457 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 10.3 mp -94.47 152.61 18.44 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.004 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -76.82 -10.37 59.33 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.95 0.405 . . . . 0.0 111.288 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -125.07 19.93 8.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.281 0.563 . . . . 0.0 111.05 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.457 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -156.23 112.25 3.03 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.701 -178.068 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -91.32 110.97 22.27 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . 0.466 ' HB2' ' CD1' ' A' ' 90' ' ' LEU . 91.2 m -101.53 162.64 12.75 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.65 0.738 . . . . 0.0 112.863 -177.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.677 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 3.1 pt20 -66.77 130.49 43.35 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.075 -1.421 . . . . 0.0 108.91 176.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.44 ' HA ' ' HB3' ' A' ' 90' ' ' LEU . 29.0 tptp -76.72 -44.97 31.24 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.173 -174.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.9 t -151.34 153.05 34.03 Favored 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 119.862 -0.735 . . . . 0.0 111.689 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 m -143.71 136.7 24.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.953 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 89.2 m -130.83 124.25 30.87 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.423 175.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.3 tt -140.6 136.56 35.72 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 CA-C-O 121.453 0.644 . . . . 0.0 111.323 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.8 m -126.56 131.37 51.56 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.44 178.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -133.59 106.99 11.89 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.815 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.12 125.01 16.99 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.33 2.02 . . . . 0.0 111.829 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.767 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 86.8 m -85.52 -178.04 6.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.549 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.112 0 N-CA-C 111.127 -0.789 . . . . 0.0 111.127 178.094 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.597 ' N ' ' HG1' ' A' ' 40' ' ' THR . . . . . . . . 0 N--CA 1.45 -0.407 0 CA-C-O 120.909 0.172 . . . . 0.0 113.192 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 19' ' ' GLN . 42.0 mm-40 -74.86 169.17 18.46 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.028 0.531 . . . . 0.0 111.737 -178.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.594 ' CD2' ' HB2' ' A' ' 39' ' ' ARG . 94.7 m95 -48.27 119.48 3.0 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.066 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 28.2 mt-30 -108.83 115.73 30.64 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 177.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -105.26 145.12 31.1 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-O 121.686 0.755 . . . . 0.0 112.95 -174.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -93.64 175.23 6.82 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.89 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.3 m -94.2 129.18 44.84 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -176.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.75 96.05 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.396 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -102.03 101.04 16.73 Favored Pre-proline 0 N--CA 1.439 -1.01 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.652 ' O ' ' HB ' ' A' ' 26' ' ' THR . 56.9 Cg_endo -71.98 -20.78 25.12 Favored 'Trans proline' 0 C--O 1.207 -1.07 0 C-N-CA 122.277 1.984 . . . . 0.0 111.068 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.652 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 7.8 m 107.41 -32.47 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.948 1.299 . . . . 0.0 110.155 177.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.9 t 75.51 -162.32 0.06 Allowed 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.482 175.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.97 -93.62 1.05 Allowed Glycine 0 CA--C 1.49 -1.53 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -175.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.459 ' O ' ' HB2' ' A' ' 30' ' ' CYS . 9.8 p-10 -160.13 58.93 0.35 Allowed 'General case' 0 C--N 1.284 -2.271 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 177.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 29' ' ' ASP . 83.3 m 83.14 97.41 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 112.717 -2.038 . . . . 0.0 110.135 -176.071 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -127.3 156.45 20.39 Favored Glycine 0 N--CA 1.434 -1.484 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.826 -178.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.5 tp -80.95 131.39 35.33 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.947 0.374 . . . . 0.0 110.29 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 25' ' ' PRO . . . -139.82 173.93 22.63 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 -176.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 p -143.55 160.14 41.16 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -174.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 35' ' ' ARG . 42.2 ttp180 -137.41 137.15 38.5 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.927 176.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.12 132.44 56.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.722 -0.217 . . . . 0.0 111.145 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -133.02 128.29 5.05 Favored Glycine 0 N--CA 1.445 -0.752 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 176.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.418 HG22 ' HB2' ' A' ' 48' ' ' MET . 66.5 p -130.99 146.9 52.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 117.532 0.666 . . . . 0.0 110.65 -176.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.594 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 6.7 ttp85 -143.83 155.51 44.15 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.597 ' HG1' ' N ' ' A' ' 16' ' ' GLY . 0.7 OUTLIER -149.44 144.0 26.06 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-O 120.781 0.324 . . . . 0.0 110.172 176.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.89 -173.48 49.41 Favored Glycine 0 CA--C 1.499 -0.925 0 N-CA-C 110.275 -1.13 . . . . 0.0 110.275 176.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.61 -30.91 69.02 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.342 0.591 . . . . 0.0 109.998 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -89.17 6.33 40.58 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.76 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 10.1 m 46.95 79.63 0.06 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.575 0.702 . . . . 0.0 112.589 -175.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.7 tptt -82.75 2.83 31.95 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.901 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.568 ' H ' HG22 ' A' ' 40' ' ' THR . 93.4 mt-30 48.67 56.27 7.85 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.915 -178.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 m -89.72 102.75 15.44 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.135 0.493 . . . . 0.0 109.937 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.418 ' HB2' HG22 ' A' ' 38' ' ' THR . 20.5 ptp -136.7 146.29 45.7 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-O 121.078 0.466 . . . . 0.0 111.902 -176.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.437 ' HA ' ' HE3' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -143.04 143.27 31.82 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.484 179.535 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 18.7 m -115.82 138.16 51.41 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.143 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -133.4 146.44 51.22 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.183 0.516 . . . . 0.0 111.518 -175.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -85.0 137.36 33.12 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 176.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.0 t -91.21 154.51 19.25 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 -177.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -112.85 138.87 49.04 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.219 0.533 . . . . 0.0 111.2 -176.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 4.9 tp -118.38 112.79 37.29 Favored Pre-proline 0 C--N 1.319 -0.729 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.888 -178.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.39 106.54 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.668 2.245 . . . . 0.0 112.079 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 79.7 m . . . . . 0 C--N 1.317 -0.807 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.146 -179.246 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.911 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -112.56 -62.95 1.5 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.937 0.398 . . . . 0.0 110.426 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.11 -5.51 25.58 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.535 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.457 ' SG ' HD21 ' A' ' 90' ' ' LEU . 11.8 t -76.78 167.82 21.16 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 176.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.415 ' O ' HD22 ' A' ' 90' ' ' LEU . 56.3 mttp -125.08 125.58 44.01 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.018 -177.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.417 ' HE1' ' HB2' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -124.56 153.56 41.95 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.802 -178.424 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -100.81 140.22 35.4 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.217 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -96.31 139.76 31.98 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.743 0.817 . . . . 0.0 109.008 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.404 HE21 ' HB3' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -77.97 164.76 24.81 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.75 28.97 1.25 Allowed 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -176.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 48.8 t-105 -87.31 -14.03 41.98 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.794 -175.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 108.11 127.07 5.56 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 119.884 -1.151 . . . . 0.0 111.075 -175.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -105.46 134.11 49.12 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-O 120.763 0.315 . . . . 0.0 111.547 -178.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 52.7 t 68.12 104.29 0.05 Allowed 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.809 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.485 ' HB2' ' OG1' ' A' ' 81' ' ' THR . 20.6 m-20 -87.49 112.06 21.81 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 177.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.38 -30.22 68.16 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.795 -175.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -67.83 -29.93 69.21 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.254 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.57 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.5 p -104.45 -8.23 19.27 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.566 -0.453 . . . . 0.0 111.163 -177.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.454 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 59.67 30.39 20.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.512 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 81' ' ' THR . 67.3 mt -129.06 160.37 33.0 Favored 'General case' 0 CA--C 1.498 -1.032 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.204 -175.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 109' ' ' CYS . 35.6 tttp -129.06 140.33 51.65 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.218 -178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.4 t -137.81 145.32 42.18 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.535 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 mtt180 -140.34 128.99 22.95 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.14 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.2 t -123.82 146.78 48.12 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.928 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -150.08 152.33 24.26 Favored Glycine 0 N--CA 1.437 -1.278 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.16 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.9 m -138.85 148.72 44.06 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.113 0.482 . . . . 0.0 111.976 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.7 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.3 tm? -79.49 126.14 30.47 Favored 'General case' 0 N--CA 1.423 -1.811 0 C-N-CA 123.939 0.895 . . . . 0.0 109.121 178.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -87.53 -33.77 18.84 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.326 -0.55 . . . . 0.0 112.325 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -160.71 141.03 11.36 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -105.22 152.51 22.77 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.935 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.689 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 3.2 mm? -91.02 176.21 6.68 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.889 0.376 . . . . 0.0 110.752 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -73.95 -27.85 61.21 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.888 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -130.45 43.69 3.08 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.697 0.761 . . . . 0.0 109.971 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.689 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -152.11 97.93 2.37 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.142 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -80.32 110.57 15.88 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 71.4 m -110.76 152.8 26.18 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.122 0.487 . . . . 0.0 111.607 -177.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.7 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 4.8 pm0 -68.46 132.71 47.47 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.677 177.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -74.25 -43.2 57.93 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 122.692 0.397 . . . . 0.0 111.333 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.3 t -155.52 146.41 22.35 Favored 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 119.216 -0.994 . . . . 0.0 112.101 175.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.0 m -133.13 138.56 51.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.545 176.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 58.3 m -129.83 127.85 41.11 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 114.726 -1.125 . . . . 0.0 108.993 177.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 19.8 pt -136.69 136.63 48.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-O 120.919 0.39 . . . . 0.0 111.163 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.6 t -126.85 135.36 50.88 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.909 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -135.53 130.98 19.16 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.415 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -52.33 126.53 20.85 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 121.27 1.313 . . . . 0.0 109.946 174.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 84' ' ' LYS . 33.7 t -101.33 -46.18 5.1 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -172.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.337 0 C-N-CA 121.085 -0.578 . . . . 0.0 113.095 -175.917 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.189 0 N-CA-C 111.667 -0.573 . . . . 0.0 111.667 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -106.31 -8.09 17.42 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.066 0.46 . . . . 0.0 110.337 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -75.98 -54.57 6.67 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.114 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 66.07 177.04 0.22 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.165 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.4 mttt 56.99 81.41 0.26 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.481 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.41 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 0.5 OUTLIER -93.38 -131.77 0.01 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 123.075 2.517 . . . . 0.0 110.873 179.02 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.41 ' H ' ' HB2' ' A' ' 6' ' ' PRO . 35.6 tt0 69.23 108.31 0.05 Allowed 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 123.776 0.83 . . . . 0.0 111.116 -179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -69.44 163.87 24.31 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.825 -177.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -73.54 148.12 43.33 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.883 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -133.58 147.59 30.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.268 0.556 . . . . 0.0 110.741 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -121.52 143.5 49.23 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.513 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -74.77 168.25 20.23 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.0 m 68.14 59.31 0.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.434 0.635 . . . . 0.0 109.777 -177.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.445 ' HA ' ' HA ' ' A' ' 42' ' ' ALA . 40.7 t0 -75.24 167.61 21.58 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.762 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 8.9 t -101.78 -55.21 2.56 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -176.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -157.44 159.88 30.13 Favored Glycine 0 N--CA 1.44 -1.039 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -92.91 166.27 12.48 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 117.085 0.443 . . . . 0.0 112.141 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 88.6 m95 -50.32 122.14 6.55 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.654 176.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -111.82 124.29 52.05 Favored 'General case' 0 N--CA 1.434 -1.235 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 175.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.429 ' CE3' ' HA3' ' A' ' 37' ' ' GLY . 98.2 m95 -104.46 136.8 43.34 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.39 0.614 . . . . 0.0 112.169 -175.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.0 m -95.42 172.07 8.31 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.192 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.0 m -90.39 130.97 38.77 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.062 0 CA-C-O 121.756 0.788 . . . . 0.0 111.034 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 43.4 t -61.18 134.46 57.04 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.35 -1.295 . . . . 0.0 112.168 -176.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.9 t -96.8 107.93 39.99 Favored Pre-proline 0 N--CA 1.438 -1.045 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.56 ' O ' ' HB ' ' A' ' 26' ' ' THR . 18.1 Cg_endo -59.55 -19.03 50.3 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.935 2.423 . . . . 0.0 112.713 -176.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.56 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 30.7 m 85.98 -66.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.029 177.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.2 t 68.23 121.69 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.463 0.649 . . . . 0.0 111.081 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 161.05 66.53 0.02 OUTLIER Glycine 0 CA--C 1.494 -1.257 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.407 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 62.07 40.3 12.18 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 39.1 m 76.91 88.91 0.08 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.126 -178.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.63 149.43 16.87 Favored Glycine 0 CA--C 1.503 -0.665 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.4 tp -78.94 116.43 19.25 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.054 0.454 . . . . 0.0 112.089 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -86.31 162.32 34.9 Favored Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.085 178.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.7 p -136.13 154.53 50.95 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.465 0.65 . . . . 0.0 112.402 -177.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -125.21 138.44 54.12 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 177.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -118.77 129.08 55.05 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 120.905 0.383 . . . . 0.0 110.999 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.429 ' HA3' ' CE3' ' A' ' 20' ' ' TRP . . . -124.55 143.5 14.72 Favored Glycine 0 N--CA 1.437 -1.238 0 N-CA-C 109.441 -1.463 . . . . 0.0 109.441 177.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.621 HG22 ' HB3' ' A' ' 48' ' ' MET . 50.7 p -133.3 158.41 43.02 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 117.637 0.719 . . . . 0.0 110.727 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.517 ' HG2' ' N ' ' A' ' 40' ' ' THR . 71.7 ttt180 -154.73 161.1 41.66 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.64 ' HA ' ' O ' ' A' ' 45' ' ' LYS . 1.3 p -106.58 145.79 31.47 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 174.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -72.89 -176.99 31.57 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.099 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.445 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . . . -70.39 -25.77 63.4 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.567 0.699 . . . . 0.0 110.441 -177.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -98.16 16.36 21.53 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.91 178.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 73.4 m 61.23 79.74 0.24 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.323 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.64 ' O ' ' HA ' ' A' ' 40' ' ' THR . 75.8 mmtt -130.36 146.03 51.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 177.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -74.75 108.46 7.51 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.03 0.443 . . . . 0.0 110.873 -177.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -115.8 136.59 52.91 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.621 ' HB3' HG22 ' A' ' 38' ' ' THR . 16.3 ptm -144.96 154.34 42.47 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -147.71 142.59 26.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.642 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.1 m -116.86 138.81 51.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-O 120.848 0.356 . . . . 0.0 110.476 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -120.48 152.66 37.71 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -104.78 127.35 52.55 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 57.6 m -90.69 -165.39 1.34 Allowed 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -175.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -117.55 140.06 50.12 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 120.772 0.32 . . . . 0.0 110.921 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 6.9 tp -109.77 120.22 45.53 Favored Pre-proline 0 C--N 1.305 -1.353 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.709 -178.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -62.51 103.44 0.32 Allowed 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.368 2.045 . . . . 0.0 111.37 177.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 8.9 t -103.07 155.66 18.23 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.572 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.7 p-10 -72.25 145.48 47.9 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 121.164 -0.214 . . . . 0.0 110.6 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 88.9 m95 66.78 89.51 0.1 Allowed 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.687 0.756 . . . . 0.0 110.643 -177.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -101.11 -169.97 1.77 Allowed 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.577 -178.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.451 ' HB3' ' NZ ' ' A' ' 61' ' ' LYS . 0.1 OUTLIER -78.42 52.17 1.12 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.366 0.603 . . . . 0.0 111.492 179.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -135.37 87.41 2.32 Favored 'General case' 0 N--CA 1.441 -0.89 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -84.72 15.74 3.69 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.819 -176.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -177.61 164.23 33.19 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.505 -0.855 . . . . 0.0 112.797 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -156.2 -79.87 0.08 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -89.6 -20.72 23.39 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 173.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.403 ' HA ' HD13 ' A' ' 94' ' ' LEU . 45.0 t -76.24 178.74 6.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.322 -1.308 . . . . 0.0 108.425 176.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -132.76 125.82 31.02 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.53 -178.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.438 ' HE1' ' O ' ' A' ' 100' ' ' GLN . 1.6 t80 -141.23 141.36 34.02 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.766 -177.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -123.7 134.02 53.79 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 110.498 -0.186 . . . . 0.0 110.498 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -97.09 131.64 43.67 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 176.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.485 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 3.6 pt20 -115.66 161.75 18.23 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -135.97 106.04 6.31 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 121.141 0.496 . . . . 0.0 111.288 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 59.3 t90 -79.06 -21.7 46.41 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.211 176.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -159.59 158.46 29.64 Favored Glycine 0 N--CA 1.434 -1.492 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.191 178.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -94.33 146.63 23.91 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 2.1 t -21.33 126.58 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.225 0 O-C-N 124.563 1.164 . . . . 0.0 112.58 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -98.29 109.16 21.96 Favored 'General case' 0 CA--C 1.494 -1.207 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 -177.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 mt -75.51 -21.21 58.19 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -177.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -67.17 -36.48 81.89 Favored 'General case' 0 CA--C 1.486 -1.496 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -174.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 74.1 p -104.87 -7.28 19.48 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.875 179.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.425 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 61.95 37.31 15.15 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.348 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.458 ' HA ' ' H ' ' A' ' 109' ' ' CYS . 66.3 mt -128.1 152.31 48.14 Favored 'General case' 0 CA--C 1.498 -1.057 0 CA-C-O 121.276 0.56 . . . . 0.0 111.873 -176.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 109' ' ' CYS . 87.0 tttt -135.65 136.48 41.0 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.725 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.1 t -134.52 144.49 48.05 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 120.904 0.383 . . . . 0.0 111.551 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -142.54 142.87 32.28 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.925 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.485 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 5.0 m -112.61 147.21 37.16 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.651 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -133.82 156.49 22.34 Favored Glycine 0 C--N 1.318 -0.467 0 C-N-CA 121.14 -0.552 . . . . 0.0 111.937 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 12.7 p -146.31 141.7 27.55 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-N 116.955 0.378 . . . . 0.0 111.941 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.622 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 5.3 tt -68.78 127.47 33.18 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.331 176.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -97.57 -31.47 12.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.613 178.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -156.77 140.07 15.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.617 0.246 . . . . 0.0 110.876 178.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.414 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -113.94 131.51 56.29 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.518 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 8.7 mp -93.19 175.94 6.59 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -178.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -76.7 -27.94 55.68 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.692 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -126.49 14.09 7.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.028 0.918 . . . . 0.0 110.698 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.518 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -143.23 91.2 2.25 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.111 177.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -103.61 152.63 21.53 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.721 -176.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . 0.445 ' HB2' HD12 ' A' ' 90' ' ' LEU . 67.8 m -134.91 156.19 49.4 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-O 121.295 0.569 . . . . 0.0 111.855 -177.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.622 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 19.5 pm0 -64.02 149.91 46.43 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 114.801 -1.091 . . . . 0.0 108.449 169.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.509 ' HA ' ' HB3' ' A' ' 90' ' ' LEU . 57.3 pttt -81.52 -31.69 32.68 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -173.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.0 t -155.69 148.82 24.55 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 119.387 -0.925 . . . . 0.0 112.451 177.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 26.8 m -134.27 143.02 39.3 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.15 0 CA-C-N 114.081 -1.418 . . . . 0.0 112.275 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 12.2 t -128.18 128.95 45.72 Favored 'General case' 0 N--CA 1.418 -2.06 0 CA-C-N 114.482 -1.236 . . . . 0.0 107.912 175.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.9 tt -141.07 139.69 33.23 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.77 0 CA-C-O 121.221 0.534 . . . . 0.0 111.375 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 16.3 m -130.41 127.48 39.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -133.52 132.53 21.91 Favored Pre-proline 0 C--N 1.305 -1.365 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.447 ' HA ' HD23 ' A' ' 83' ' ' LEU . 50.8 Cg_exo -51.21 118.07 3.98 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 121.561 1.507 . . . . 0.0 110.956 178.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.458 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 9.4 t -77.52 -30.06 52.71 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.239 -176.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -88.06 -168.46 44.36 Favored Glycine 0 N--CA 1.437 -1.279 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -155.79 164.23 38.81 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-O 120.729 0.299 . . . . 0.0 110.275 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 79.0 mt -84.29 158.06 21.33 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 177.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 20.3 p -68.25 114.29 6.6 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.435 0.635 . . . . 0.0 111.812 -178.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -120.54 96.56 48.93 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.663 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.71 141.72 95.66 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.757 2.304 . . . . 0.0 112.782 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -87.14 -42.25 0.53 Allowed Pre-proline 0 C--N 1.306 -1.286 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.19 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo -88.27 104.17 0.48 Allowed 'Trans proline' 0 C--N 1.37 1.664 0 C-N-CA 121.948 1.765 . . . . 0.0 111.396 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -78.52 140.88 38.51 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.073 -179.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -71.55 175.76 5.31 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.74 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -56.26 -37.17 69.43 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.317 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 34.4 m 61.25 -166.86 0.2 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.754 177.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -84.94 111.84 20.04 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 58.6 pttt -72.88 -4.66 33.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.04 0.448 . . . . 0.0 111.437 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -102.42 25.39 9.06 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.536 178.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -60.53 -35.61 76.42 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.15 0.5 . . . . 0.0 110.515 179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -124.58 140.09 53.27 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.715 177.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -75.52 122.28 23.64 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.13 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -130.94 159.35 22.98 Favored Glycine 0 N--CA 1.437 -1.281 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.709 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -98.28 99.79 11.03 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 120.791 0.329 . . . . 0.0 110.268 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 49.5 tptt -76.64 113.23 14.05 Favored 'General case' 0 N--CA 1.426 -1.652 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -66.69 140.16 57.88 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.163 -176.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 44.96 36.85 2.09 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.688 1.195 . . . . 0.0 113.303 177.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 94.3 mttt 62.72 -88.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.688 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 75.2 mtp -146.99 21.11 1.25 Allowed 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.006 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 47.1 tp 66.84 86.68 0.13 Allowed 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.954 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 C--N 1.31 -1.133 0 CA-C-N 114.779 -1.101 . . . . 0.0 109.394 179.102 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.377 0 N-CA-C 111.689 -0.564 . . . . 0.0 111.689 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -104.96 -15.82 15.02 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.877 0.37 . . . . 0.0 111.41 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -113.48 92.07 3.87 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.964 0.411 . . . . 0.0 112.059 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -111.91 -56.22 2.41 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -149.32 71.84 10.01 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.79 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.413 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 2.1 Cg_endo -86.81 -137.48 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.796 2.331 . . . . 0.0 111.247 -177.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.413 ' H ' ' HB2' ' A' ' 6' ' ' PRO . 36.0 tt0 61.76 78.63 0.28 Allowed 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.838 -177.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -164.24 -74.44 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.023 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.6 tttt 67.52 135.83 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.452 0.701 . . . . 0.0 112.232 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.6 p -103.5 144.18 14.42 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.098 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.906 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 pttt -147.38 96.37 2.69 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.061 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -131.65 67.98 1.5 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.398 0.618 . . . . 0.0 111.38 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.8 m -126.51 25.26 6.54 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 122.121 0.962 . . . . 0.0 108.498 177.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -75.74 146.33 40.15 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 113.754 -1.566 . . . . 0.0 112.351 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.784 ' SG ' ' HA3' ' A' ' 41' ' ' GLY . 5.2 t 92.7 -77.32 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 124.846 1.258 . . . . 0.0 110.269 171.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -178.3 174.18 46.5 Favored Glycine 0 N--CA 1.435 -1.38 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -109.46 166.17 11.09 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.518 0.675 . . . . 0.0 111.243 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.422 ' HA ' ' O ' ' A' ' 38' ' ' THR . 98.6 m95 -65.08 128.98 38.05 Favored 'General case' 0 N--CA 1.418 -2.067 0 CA-C-N 114.462 -1.245 . . . . 0.0 111.413 174.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -87.66 137.96 31.88 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 176.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -110.27 124.02 50.87 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 121.324 0.583 . . . . 0.0 112.329 -174.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.0 m -107.13 168.51 9.16 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.21 -0.905 . . . . 0.0 108.961 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.6 m -96.51 152.9 3.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.569 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 79.3 m -66.91 129.85 41.24 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.788 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 17.1 m -109.29 111.1 60.14 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.799 176.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.06 156.83 63.96 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.404 2.07 . . . . 0.0 111.686 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.6 m -91.25 -25.81 19.31 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-O 121.247 0.546 . . . . 0.0 109.549 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -160.56 136.75 8.54 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.644 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -69.94 -26.96 73.69 Favored Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -80.99 54.24 2.16 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 177.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 61.4 m 59.41 88.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.114 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.519 ' H ' HD13 ' A' ' 55' ' ' ILE . . . -144.34 141.82 10.48 Favored Glycine 0 N--CA 1.437 -1.252 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.531 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.7 tp -57.04 152.15 13.73 Favored 'General case' 0 C--O 1.203 -1.392 0 C-N-CA 122.502 0.321 . . . . 0.0 111.38 -177.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.0 171.77 22.31 Favored Glycine 0 N--CA 1.438 -1.23 0 N-CA-C 110.57 -1.012 . . . . 0.0 110.57 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.4 p -135.68 154.18 51.37 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 117.441 0.62 . . . . 0.0 112.06 -178.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -137.09 142.2 42.35 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 175.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -130.25 130.87 45.14 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 120.757 0.313 . . . . 0.0 111.627 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.54 145.81 17.52 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.422 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 71.2 p -134.91 154.76 51.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 117.843 0.821 . . . . 0.0 111.115 -177.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -118.11 154.51 31.99 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.2 m -150.73 161.87 41.8 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 120.291 -0.564 . . . . 0.0 110.387 -175.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.784 ' HA3' ' SG ' ' A' ' 15' ' ' CYS . . . 166.16 -173.44 41.68 Favored Glycine 0 N--CA 1.434 -1.47 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.54 -32.72 64.36 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 117.593 0.696 . . . . 0.0 111.411 -178.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -105.52 0.97 27.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.961 0.41 . . . . 0.0 111.843 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 78.2 m -98.71 117.32 32.91 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 120.91 0.386 . . . . 0.0 111.858 -177.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.77 140.56 40.68 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.793 175.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 62.53 19.79 11.49 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.671 0.607 . . . . 0.0 111.466 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -84.11 77.89 9.86 Favored 'General case' 0 N--CA 1.437 -1.105 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 177.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 55.2 mtt -134.31 152.86 52.05 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.057 -175.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -148.54 131.45 16.15 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.374 178.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.2 m -117.1 138.02 51.91 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -131.62 152.24 50.98 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 120.729 0.299 . . . . 0.0 110.824 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -85.95 129.44 34.83 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 176.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 9.1 t -95.78 178.83 5.32 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -175.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -113.65 141.14 47.58 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.438 0.637 . . . . 0.0 111.284 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.519 HD13 ' H ' ' A' ' 31' ' ' GLY . 12.4 tt -123.59 120.29 26.93 Favored Pre-proline 0 C--N 1.299 -1.605 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.64 178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 55' ' ' ILE . 12.4 Cg_exo -70.41 98.44 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.375 2.05 . . . . 0.0 111.822 178.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 54.1 t -80.85 114.03 19.46 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.924 178.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -84.67 129.21 34.86 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.942 0.401 . . . . 0.0 111.623 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 48.3 m95 53.61 68.07 0.9 Allowed 'General case' 0 C--O 1.239 0.522 0 CA-C-N 114.981 -1.009 . . . . 0.0 112.339 177.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -91.95 -11.83 35.06 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.628 0.727 . . . . 0.0 109.385 177.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -65.88 114.11 4.86 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.707 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -142.65 24.66 1.87 Allowed 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.13 -177.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 79.3 t80 75.95 -37.3 0.31 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.622 0.769 . . . . 0.0 112.335 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -158.24 132.12 3.03 Favored Glycine 0 C--N 1.29 -2.008 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.626 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.06 -75.99 0.59 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.622 0.248 . . . . 0.0 110.701 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -93.68 -21.58 19.27 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.161 0.505 . . . . 0.0 110.588 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 56.3 m -83.42 160.52 21.56 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.378 178.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -130.81 127.82 39.43 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.858 ' CE2' ' HB2' ' A' ' 90' ' ' LEU . 54.8 m-85 -109.27 128.47 55.1 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.611 -178.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -100.51 117.58 34.94 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 177.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.565 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 44.2 p90 -99.02 145.11 27.41 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-O 120.83 0.347 . . . . 0.0 111.158 -176.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -89.78 162.34 15.57 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 71.74 116.85 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 O-C-N 124.16 0.912 . . . . 0.0 110.661 -175.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -89.11 -3.12 58.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.757 0.789 . . . . 0.0 109.826 -177.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.92 140.13 11.54 Favored Glycine 0 N--CA 1.436 -1.336 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.943 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -107.98 141.23 39.95 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.626 ' HA ' ' HB3' ' A' ' 84' ' ' LYS . 48.9 t 79.53 102.24 0.07 Allowed 'General case' 0 CA--C 1.505 -0.753 0 CA-C-O 121.662 0.744 . . . . 0.0 110.777 -178.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -83.73 111.85 19.54 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 114.874 -1.057 . . . . 0.0 108.51 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.552 ' H ' HD23 ' A' ' 79' ' ' LEU . 2.5 pt? -63.82 -31.81 73.12 Favored 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 114.612 -1.176 . . . . 0.0 113.254 -173.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -74.95 -28.7 60.69 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.438 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.626 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.7 p -105.19 -8.55 18.29 Favored 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 120.004 -0.678 . . . . 0.0 112.44 -175.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.32 25.08 12.33 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 123.466 0.706 . . . . 0.0 110.625 -175.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 81' ' ' THR . 44.9 mt -128.71 149.49 50.67 Favored 'General case' 0 C--O 1.202 -1.437 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.121 -177.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.626 ' HB3' ' HA ' ' A' ' 77' ' ' CYS . 8.3 ptmt -121.58 135.46 55.0 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 120.879 0.371 . . . . 0.0 110.246 177.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.3 m -137.95 138.3 38.82 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -177.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -140.33 136.42 33.19 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 120.814 0.34 . . . . 0.0 110.179 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.5 m -128.75 134.23 48.36 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.63 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.565 ' HA2' ' HA ' ' A' ' 71' ' ' PHE . . . -135.69 152.3 20.92 Favored Glycine 0 CA--C 1.495 -1.214 0 C-N-CA 120.466 -0.874 . . . . 0.0 111.784 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.404 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 20.1 p -141.04 146.42 37.18 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.24 0.543 . . . . 0.0 111.961 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.858 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.8 tm? -91.29 121.46 33.05 Favored 'General case' 0 N--CA 1.421 -1.888 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -97.4 -12.39 22.81 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -174.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 92' ' ' ARG . 14.9 ttm180 -161.57 133.76 5.8 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.564 0.221 . . . . 0.0 110.496 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -113.6 148.6 35.91 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.448 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 9.8 mp -85.74 172.09 11.09 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 -178.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -78.46 -18.38 54.95 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.112 0.482 . . . . 0.0 110.404 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -119.63 37.6 4.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.698 0.761 . . . . 0.0 109.706 179.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.448 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -157.63 124.26 4.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.335 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -111.1 122.98 49.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.648 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . 0.455 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 74.7 m -145.68 148.3 32.9 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.956 -0.566 . . . . 0.0 112.177 -178.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.74 152.54 45.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.267 178.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -73.52 -35.72 65.62 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.915 -175.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 9.3 t -156.26 148.91 23.8 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 118.877 -1.129 . . . . 0.0 113.449 179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.1 m -131.63 139.26 51.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 113.8 -1.546 . . . . 0.0 110.83 175.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 56.7 m -129.74 133.78 47.22 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.411 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -136.48 132.08 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 4.8 m -131.82 126.28 33.94 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -135.5 138.17 27.89 Favored Pre-proline 0 C--N 1.319 -0.722 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -62.71 123.15 11.81 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 121.7 1.6 . . . . 0.0 110.252 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.417 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 13.4 t -83.16 178.37 8.14 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.763 0.316 . . . . 0.0 110.479 -176.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 92.03 -45.81 2.66 Favored Glycine 0 N--CA 1.445 -0.759 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -177.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -85.74 112.76 21.35 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.652 -0.274 . . . . 0.0 110.493 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 57.94 86.99 0.07 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.464 -0.789 . . . . 0.0 112.374 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 19.6 p -91.92 122.49 34.49 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.097 178.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -152.8 89.2 3.79 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-O 120.719 0.295 . . . . 0.0 110.956 -178.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -67.06 146.02 75.48 Favored 'Trans proline' 0 CA--C 1.514 -0.504 0 C-N-CA 122.699 2.266 . . . . 0.0 111.912 177.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.474 ' N ' ' HD3' ' A' ' 117' ' ' PRO . 40.4 ttmt -149.5 60.55 4.62 Favored Pre-proline 0 C--N 1.309 -1.178 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.452 174.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.474 ' HD3' ' N ' ' A' ' 116' ' ' LYS . 35.7 Cg_exo -61.7 89.73 0.1 Allowed 'Trans proline' 0 C--N 1.365 1.415 0 C-N-CA 122.366 2.044 . . . . 0.0 111.58 175.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -94.32 -29.7 14.9 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.06 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -69.93 100.84 1.64 Allowed 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.343 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.401 ' HG3' ' NZ ' ' A' ' 123' ' ' LYS . 6.9 pt-20 -97.24 130.8 44.41 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.769 -178.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 21.9 p -127.68 -165.42 1.48 Allowed 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.456 178.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 75.8 -1.72 2.92 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.401 ' NZ ' ' HG3' ' A' ' 120' ' ' GLU . 14.5 pttm -83.71 -0.58 51.41 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.072 0.463 . . . . 0.0 111.096 178.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -112.54 135.77 52.86 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 176.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -73.71 -24.47 59.93 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.116 0.484 . . . . 0.0 110.016 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -102.73 135.27 44.69 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.646 -0.707 . . . . 0.0 109.917 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -143.26 144.08 31.99 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.894 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 148.54 88.0 0.07 OUTLIER Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 -177.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -95.48 26.18 4.04 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -81.27 106.13 13.01 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.744 -176.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -129.65 95.94 4.12 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 176.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -107.41 -179.67 3.99 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.631 -176.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -69.12 133.95 48.69 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.402 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 93.7 mmm -93.42 102.55 14.79 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 177.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 8.5 mp 70.36 135.31 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.655 0.782 . . . . 0.0 111.688 -177.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 . . . . . 0 C--N 1.312 -1.04 0 CA-C-O 118.662 -0.685 . . . . 0.0 110.199 -179.184 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.526 0 N-CA-C 111.822 -0.511 . . . . 0.0 111.822 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 53.9 mtmt -77.85 110.97 13.21 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -64.12 108.12 1.46 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.722 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.429 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 0.5 OUTLIER -93.43 35.96 1.09 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.348 -179.111 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.6 mttt 63.36 77.23 0.33 Allowed Pre-proline 0 N--CA 1.469 0.477 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.841 -178.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -92.06 -85.44 0.0 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.601 0 C-N-CA 122.739 2.293 . . . . 0.0 113.01 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -88.67 155.6 19.5 Favored 'General case' 0 C--N 1.287 -2.135 0 CA-C-N 114.832 -1.076 . . . . 0.0 112.036 -178.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.1 tptp 74.44 -48.56 0.65 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.544 1.138 . . . . 0.0 112.056 178.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -110.71 104.07 12.69 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-O 121.223 0.535 . . . . 0.0 110.174 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.7 p -89.15 152.96 3.26 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.395 -177.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -80.99 137.29 36.08 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.086 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.3 tttm 57.4 94.18 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 123.579 0.752 . . . . 0.0 112.151 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.7 p -77.64 -10.51 59.55 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 121.854 0.835 . . . . 0.0 110.184 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -87.82 149.07 24.37 Favored 'General case' 0 C--N 1.291 -1.945 0 CA-C-N 114.035 -1.439 . . . . 0.0 109.772 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 74.4 m 70.5 81.32 0.16 Allowed 'General case' 0 C--O 1.233 0.217 0 O-C-N 123.695 0.622 . . . . 0.0 110.487 -177.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.13 174.69 40.25 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.324 -0.941 . . . . 0.0 112.193 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 19' ' ' GLN . 42.3 mt-10 -75.83 171.3 14.62 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 122.46 0.304 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.677 ' HA ' ' O ' ' A' ' 38' ' ' THR . 88.5 m95 -45.92 119.51 2.27 Favored 'General case' 0 N--CA 1.442 -0.839 0 O-C-N 123.894 0.746 . . . . 0.0 112.698 -177.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.47 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 68.3 mt-30 -113.15 115.56 28.46 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -100.45 138.69 37.17 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.225 0.536 . . . . 0.0 111.481 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.0 t -101.33 172.44 6.99 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.416 -0.811 . . . . 0.0 108.895 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 29.1 m -91.95 148.56 4.56 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 -177.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 62.3 m -63.6 128.41 35.7 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.829 -175.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 p -106.23 114.79 61.99 Favored Pre-proline 0 N--CA 1.44 -0.93 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -61.29 148.09 93.83 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.599 2.2 . . . . 0.0 112.972 -176.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.3 m -87.64 -28.53 21.81 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-O 121.678 0.752 . . . . 0.0 109.195 178.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 46.3 t -149.95 134.58 17.56 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.888 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.07 -30.57 69.78 Favored Glycine 0 CA--C 1.504 -0.616 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.338 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.557 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 6.5 m-20 -68.17 -41.47 81.44 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.3 m 166.02 92.15 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.583 1.153 . . . . 0.0 110.847 178.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -141.31 120.09 1.62 Allowed Glycine 0 CA--C 1.498 -0.976 0 C-N-CA 120.469 -0.872 . . . . 0.0 111.895 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.452 ' H ' HD22 ' A' ' 32' ' ' LEU . 3.2 mm? -53.68 114.13 1.43 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.998 0.428 . . . . 0.0 111.671 -176.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.96 175.77 53.96 Favored Glycine 0 N--CA 1.441 -1.008 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.886 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.0 p -136.42 154.66 50.73 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 -178.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -133.71 146.04 50.44 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.001 176.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -120.82 131.56 54.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.514 0.197 . . . . 0.0 110.649 -178.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.47 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -128.21 151.37 18.76 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.697 -0.961 . . . . 0.0 110.697 178.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.677 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 58.8 p -130.0 149.37 51.75 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 117.395 0.598 . . . . 0.0 111.25 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.502 ' HB2' ' CE2' ' A' ' 18' ' ' TRP . 53.2 ttp180 -132.24 161.4 33.53 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.496 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 9.0 t -113.75 162.7 15.97 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-O 121.756 0.788 . . . . 0.0 111.087 178.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -111.82 -174.29 19.67 Favored Glycine 0 C--N 1.294 -1.788 0 CA-C-N 114.042 -1.435 . . . . 0.0 110.058 177.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.94 -30.51 69.83 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 117.562 0.681 . . . . 0.0 110.099 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -101.93 5.44 40.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.412 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.429 ' HA ' ' OG1' ' A' ' 40' ' ' THR . 52.9 t 60.51 70.85 0.6 Allowed 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.991 -175.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -90.89 -18.41 24.84 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.055 -178.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.436 ' HA ' ' O ' ' A' ' 39' ' ' ARG . 15.3 mm100 66.74 100.56 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.893 0.854 . . . . 0.0 112.829 178.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 m -101.72 143.32 31.8 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 114.74 -1.118 . . . . 0.0 108.542 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -120.85 152.59 38.21 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.16 -0.616 . . . . 0.0 111.18 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -141.89 136.07 30.12 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 177.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.9 m -129.77 136.72 49.96 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -133.64 151.1 51.6 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-O 121.053 0.454 . . . . 0.0 111.294 -176.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.463 ' HD2' ' N ' ' A' ' 52' ' ' ARG . 0.2 OUTLIER -101.91 128.1 48.45 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.44 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 31.7 m -92.65 170.58 9.61 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 -174.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.7 mttm -113.79 139.91 48.74 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.371 0.605 . . . . 0.0 112.125 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.9 mt -112.37 131.54 22.55 Favored Pre-proline 0 C--N 1.305 -1.369 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.631 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.449 ' O ' ' HB2' ' A' ' 57' ' ' CYS . 9.5 Cg_endo -52.45 -54.5 5.08 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.426 2.75 . . . . 0.0 113.486 -178.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 56' ' ' PRO . 41.9 m 73.43 -51.18 0.7 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.085 0.554 . . . . 0.0 112.357 -178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -75.95 132.43 40.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.176 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 91.1 m95 54.72 42.87 30.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.401 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.557 ' HE3' ' O ' ' A' ' 29' ' ' ASP . 22.3 pttm -86.04 6.0 30.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.018 0.437 . . . . 0.0 111.234 178.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -81.6 131.31 35.27 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.031 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -164.24 123.19 1.9 Allowed 'General case' 0 N--CA 1.439 -1.018 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 -178.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -72.54 129.97 39.54 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.316 -178.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -136.56 172.71 22.39 Favored Glycine 0 N--CA 1.442 -0.949 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -132.66 1.19 3.66 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -82.92 -20.93 34.41 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.245 0.545 . . . . 0.0 110.455 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.404 ' HB2' HD21 ' A' ' 90' ' ' LEU . 6.5 p -99.67 -176.48 3.28 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 175.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -129.85 142.44 50.67 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 120.235 -0.586 . . . . 0.0 110.491 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.429 ' CE2' HD23 ' A' ' 90' ' ' LEU . 29.6 m-85 -117.44 152.49 34.89 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.01 -178.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -124.96 118.77 26.98 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.406 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 28.3 p90 -95.79 135.57 37.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.201 0.524 . . . . 0.0 111.135 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.482 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 0.2 OUTLIER -110.5 162.17 14.96 Favored 'General case' 0 N--CA 1.439 -1.003 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.808 -178.577 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -124.55 87.27 2.69 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.152 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 47.9 t-105 -87.24 -24.35 24.42 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.417 0.627 . . . . 0.0 109.526 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -161.62 118.19 0.81 Allowed Glycine 0 N--CA 1.439 -1.154 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.764 178.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -96.85 116.23 28.8 Favored 'General case' 0 N--CA 1.435 -1.191 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.491 ' SG ' ' HG3' ' A' ' 84' ' ' LYS . 55.7 m 59.99 102.06 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 O-C-N 123.917 0.76 . . . . 0.0 112.022 -176.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -69.81 111.94 5.9 Favored 'General case' 0 CA--C 1.498 -1.057 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 177.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 20.2 mt -69.29 -28.93 66.71 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.695 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -65.27 -38.59 90.77 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.219 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 65.7 p -106.72 -14.59 14.97 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.278 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 69.48 39.89 1.53 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.921 -1.036 . . . . 0.0 108.727 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.464 ' HA ' ' H ' ' A' ' 109' ' ' CYS . 90.3 mt -125.34 168.01 14.13 Favored 'General case' 0 C--O 1.204 -1.321 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.859 -178.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.491 ' HG3' ' SG ' ' A' ' 77' ' ' CYS . 36.1 tttm -121.15 137.44 54.67 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -177.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 14.2 t -137.12 146.7 45.37 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.495 0.664 . . . . 0.0 110.878 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -137.56 135.54 36.77 Favored 'General case' 0 C--N 1.289 -2.03 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.39 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.482 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 33.4 m -107.44 141.97 38.0 Favored 'General case' 0 N--CA 1.436 -1.142 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.406 ' HA2' ' HA ' ' A' ' 71' ' ' PHE . . . -136.47 152.57 21.25 Favored Glycine 0 N--CA 1.436 -1.348 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 178.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.494 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 19.0 m -141.08 147.94 39.37 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 121.063 0.459 . . . . 0.0 111.28 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.587 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.1 tm? -72.73 119.03 16.4 Favored 'General case' 0 N--CA 1.408 -2.571 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.388 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -105.39 -25.69 12.27 Favored 'General case' 0 C--N 1.312 -1.022 0 C-N-CA 120.429 -0.509 . . . . 0.0 111.114 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 37.9 ttm180 -155.85 133.61 11.15 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.042 0.448 . . . . 0.0 111.004 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -135.47 150.72 49.89 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.788 178.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.4 mp -84.49 158.99 20.82 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 177.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -68.29 -27.08 66.0 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.757 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -100.37 38.85 1.43 Allowed 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.509 0.671 . . . . 0.0 109.304 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.83 99.26 1.39 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.626 -177.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -84.23 133.19 34.59 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.974 179.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 74.8 m -145.94 140.71 27.13 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.811 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.587 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -67.54 153.87 42.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.707 178.647 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.61 ' HD3' ' H ' ' A' ' 101' ' ' LYS . 0.3 OUTLIER -73.93 -26.52 60.56 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.316 -174.671 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.494 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 8.8 t -149.22 149.82 31.59 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-O 122.016 0.912 . . . . 0.0 113.043 179.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 29.6 m -129.17 144.04 39.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 113.857 -1.52 . . . . 0.0 110.749 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 34.6 m -129.51 131.8 46.72 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.839 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -137.09 136.39 47.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.807 0.337 . . . . 0.0 110.358 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.3 p -123.18 137.0 55.0 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.549 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -134.46 128.78 19.32 Favored Pre-proline 0 C--O 1.21 -1.019 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.553 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -50.29 126.21 16.95 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 122.129 1.886 . . . . 0.0 112.394 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.464 ' H ' ' HA ' ' A' ' 83' ' ' LEU . 43.1 t -97.71 107.13 19.56 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.569 -177.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -142.23 -77.81 0.04 OUTLIER Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.072 179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -125.63 168.38 13.8 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.823 -0.222 . . . . 0.0 110.881 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 40.3 tp 60.6 74.84 0.43 Allowed 'General case' 0 C--O 1.238 0.454 0 O-C-N 123.975 0.797 . . . . 0.0 110.572 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 6.8 p -104.49 142.79 33.98 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.206 -178.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.414 ' HD3' ' C ' ' A' ' 114' ' ' LYS . 9.5 tmtt? -125.62 92.42 46.62 Favored Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -76.76 -161.54 0.14 Allowed 'Trans proline' 0 CA--C 1.531 0.373 0 C-N-CA 123.108 2.539 . . . . 0.0 113.089 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.648 ' H ' ' CD ' ' A' ' 117' ' ' PRO . 64.3 tttp -160.03 -40.52 0.0 OUTLIER Pre-proline 0 CA--C 1.55 0.978 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.653 -179.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.648 ' CD ' ' H ' ' A' ' 116' ' ' LYS . 14.7 Cg_exo -70.9 128.69 15.31 Favored 'Trans proline' 0 C--N 1.378 2.092 0 C-N-CA 121.62 1.547 . . . . 0.0 111.017 179.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -77.99 -22.06 49.95 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.412 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -101.71 154.05 19.24 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.338 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.477 ' OE1' ' HE2' ' A' ' 122' ' ' LYS . 29.3 mm-40 -70.12 105.45 2.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.317 0.579 . . . . 0.0 110.479 178.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 20.2 m -99.23 34.05 2.26 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.052 -177.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.477 ' HE2' ' OE1' ' A' ' 120' ' ' GLU . 67.6 mttm -72.63 96.53 2.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.111 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -72.96 109.77 6.76 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.741 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -85.2 139.2 31.84 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.374 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -82.79 101.17 10.76 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -125.16 167.61 14.58 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.409 -177.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -81.99 94.78 7.23 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 121.215 0.531 . . . . 0.0 110.24 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -138.77 61.84 0.57 Allowed Glycine 0 N--CA 1.44 -1.056 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.27 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -145.97 119.24 8.93 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.717 0.294 . . . . 0.0 110.77 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -70.51 133.77 47.1 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -71.98 119.31 15.98 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -70.3 97.54 1.26 Allowed 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.16 0.505 . . . . 0.0 112.116 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -93.0 142.72 26.98 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.794 177.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 91.4 mmm -69.46 158.14 35.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.993 0.425 . . . . 0.0 111.667 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 81.9 mt -81.56 170.89 15.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.36 178.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.226 178.913 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.063 0 N-CA-C 111.678 -0.569 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -75.95 93.81 3.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.62 0.248 . . . . 0.0 110.454 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.2 pttp -171.13 170.01 6.28 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.249 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -94.56 178.85 5.47 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.725 176.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm 54.5 88.53 0.12 Allowed Pre-proline 0 CA--C 1.533 0.324 0 C-N-CA 123.283 0.633 . . . . 0.0 112.458 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.91 -91.14 0.0 OUTLIER 'Trans proline' 0 CA--C 1.514 -0.504 0 C-N-CA 122.502 2.135 . . . . 0.0 111.781 177.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 67.17 163.04 0.19 Allowed 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.991 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 24.0 tttp -138.96 -167.22 2.17 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm 68.53 -177.45 0.21 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.174 0.511 . . . . 0.0 111.208 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 11.2 p -140.47 150.34 21.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.359 177.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -94.22 179.61 5.25 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.014 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -76.54 -29.67 56.8 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 175.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 53.1 p -99.07 97.82 8.91 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.443 174.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.477 ' O ' ' HB3' ' A' ' 15' ' ' CYS . 7.8 p-10 -114.57 165.33 12.89 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.916 -175.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.477 ' HB3' ' O ' ' A' ' 14' ' ' ASP . 49.4 t 95.15 -40.35 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.03 1.332 . . . . 0.0 111.816 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.487 ' O ' ' HD2' ' A' ' 39' ' ' ARG . . . 179.06 128.88 1.23 Allowed Glycine 0 N--CA 1.438 -1.2 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -102.91 164.62 11.51 Favored 'General case' 0 CA--C 1.494 -1.198 0 CA-C-N 117.341 0.57 . . . . 0.0 110.552 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.576 ' HA ' ' O ' ' A' ' 38' ' ' THR . 74.6 m95 -52.57 118.14 3.4 Favored 'General case' 0 N--CA 1.428 -1.531 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 178.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.2 mm-40 -119.33 112.74 19.81 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 172.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -97.35 145.08 26.48 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 115.812 -0.631 . . . . 0.0 112.042 -177.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.8 m -93.77 171.68 8.72 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.955 -1.02 . . . . 0.0 108.583 177.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.496 ' HA ' ' NE2' ' A' ' 131' ' ' GLN . 35.3 m -93.53 155.71 3.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.253 -176.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 38.0 t -69.03 99.98 1.16 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 -176.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.2 p -94.48 132.96 27.75 Favored Pre-proline 0 C--N 1.316 -0.875 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.652 -178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.0 110.94 0.75 Allowed 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.641 2.227 . . . . 0.0 111.728 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 97.0 m -65.95 -23.14 66.54 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.146 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.449 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 12.2 t -133.14 176.56 8.4 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.927 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.47 80.26 0.01 OUTLIER Glycine 0 C--N 1.334 0.454 0 O-C-N 124.006 0.816 . . . . 0.0 113.658 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.9 t70 76.67 -38.99 0.33 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.506 1.122 . . . . 0.0 111.939 175.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 47.4 t -123.66 109.61 13.94 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.934 179.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.449 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -172.94 154.99 22.0 Favored Glycine 0 CA--C 1.491 -1.42 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 -178.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.5 tp -64.13 108.99 1.69 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 118.224 1.012 . . . . 0.0 109.01 178.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.26 175.31 25.12 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.113 -0.948 . . . . 0.0 114.825 -173.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.84 153.66 50.72 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.694 -0.753 . . . . 0.0 111.395 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -144.15 138.35 28.09 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -115.57 132.01 56.76 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.797 -0.183 . . . . 0.0 111.333 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -131.24 136.22 8.69 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 177.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.576 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 6.9 p -123.89 148.24 46.99 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 121.194 -0.202 . . . . 0.0 111.076 -178.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.556 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 11.2 tpt85 -157.01 160.1 38.67 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.58 146.17 26.38 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.513 175.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -98.72 -150.35 25.78 Favored Glycine 0 C--O 1.217 -0.967 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.84 -36.56 49.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 118.085 0.942 . . . . 0.0 109.681 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 20.6 mm-40 -85.47 -0.52 55.15 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.216 174.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 5.2 m 40.05 60.57 1.7 Allowed 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.749 -179.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 36.2 mmtm -118.28 141.8 48.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.028 0.442 . . . . 0.0 112.038 -178.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.445 ' O ' ' HG3' ' A' ' 48' ' ' MET . 47.9 mt-30 45.22 -108.34 0.15 Allowed 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.082 -176.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.441 ' O ' ' HB3' ' A' ' 39' ' ' ARG . 0.8 OUTLIER 48.32 27.74 1.43 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 178.693 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.445 ' HG3' ' O ' ' A' ' 46' ' ' GLN . 86.9 mtp -113.96 146.12 40.57 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 177.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -147.6 137.37 22.76 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.469 0.652 . . . . 0.0 111.78 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.1 p -114.4 138.46 50.54 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 174.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -134.1 151.53 51.42 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-O 121.875 0.845 . . . . 0.0 112.098 -174.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -85.67 139.05 31.7 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 113.677 -1.601 . . . . 0.0 109.144 172.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 52.9 t -117.98 159.24 23.5 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -173.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.5 tttm -114.27 124.88 53.11 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 52.9 mt -101.94 128.47 28.61 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.413 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.78 48.66 2.25 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 123.131 2.554 . . . . 0.0 113.107 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 26.8 p -104.03 177.53 4.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.712 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -77.87 147.22 35.22 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.227 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 79.5 m95 60.52 100.47 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.872 0.733 . . . . 0.0 111.504 -178.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -128.12 149.62 50.34 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.496 -177.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -129.41 170.23 13.93 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.587 176.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -159.7 39.76 0.2 Allowed 'General case' 0 N--CA 1.434 -1.258 0 CA-C-O 121.315 0.578 . . . . 0.0 109.567 -177.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -96.16 179.79 4.93 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.84 -178.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -123.47 -162.91 11.62 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.833 -0.699 . . . . 0.0 111.992 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.62 -62.87 1.43 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.878 0.37 . . . . 0.0 110.731 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -86.28 -5.15 59.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.131 0.491 . . . . 0.0 110.505 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 62.8 m -65.73 141.01 58.49 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.686 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -116.8 125.39 51.53 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.467 ' HE2' ' HB2' ' A' ' 90' ' ' LEU . 36.5 m-85 -126.41 146.85 49.91 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 113.38 0.882 . . . . 0.0 113.38 -173.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.44 ' HB2' ' HE3' ' A' ' 91' ' ' LYS . 64.2 tt0 -126.49 115.73 20.01 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 106.189 -1.782 . . . . 0.0 106.189 170.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -101.29 156.42 17.46 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -173.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 35.3 tt0 -78.66 144.76 35.07 Favored 'General case' 0 N--CA 1.4 -2.971 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 172.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' A' ' 72' ' ' GLN . . . 166.5 120.91 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.288 0.367 . . . . 0.0 110.45 -173.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' TRP . . . . . 0.513 ' CZ3' ' HB2' ' A' ' 76' ' ' GLU . 1.1 p-90 -92.16 -8.66 44.95 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 121.239 0.542 . . . . 0.0 110.379 176.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 107.87 -39.32 2.94 Favored Glycine 0 CA--C 1.507 -0.437 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.04 175.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.513 ' HB2' ' CZ3' ' A' ' 74' ' ' TRP . 36.9 mt-10 -95.65 142.6 27.77 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 114.978 -0.611 . . . . 0.0 110.34 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 31.0 p -78.31 171.14 15.51 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 176.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -94.06 121.53 35.64 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.491 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 20.8 mt -72.83 -30.15 63.8 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.14 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -67.45 -33.36 74.98 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-O 121.321 0.581 . . . . 0.0 110.125 -177.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.723 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 76.8 p -104.27 -9.25 18.72 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.643 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.19 24.64 11.62 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.126 0.97 . . . . 0.0 111.475 -177.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.723 ' HG ' ' O ' ' A' ' 81' ' ' THR . 65.6 mt -131.39 165.08 24.28 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-O 120.961 0.41 . . . . 0.0 110.41 -172.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -119.83 132.71 55.66 Favored 'General case' 0 N--CA 1.414 -2.253 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 3.2 p -135.14 142.0 46.09 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.027 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 51.6 mtm180 -139.94 128.49 22.93 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.2 m -99.95 145.34 27.96 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -145.31 149.37 21.49 Favored Glycine 0 N--CA 1.434 -1.478 0 C-N-CA 118.879 -1.629 . . . . 0.0 112.664 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 101' ' ' LYS . 29.1 m -132.12 149.34 52.43 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.103 -0.549 . . . . 0.0 111.015 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.595 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.1 tm? -75.48 122.04 23.25 Favored 'General case' 0 N--CA 1.414 -2.268 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.44 ' HE3' ' HB2' ' A' ' 70' ' ' GLN . 11.4 ptpt -101.26 -15.23 17.36 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -177.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -162.55 130.82 3.97 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.439 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -138.22 144.19 40.5 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.4 mp -91.28 170.54 9.9 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.442 178.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -69.54 -13.42 62.33 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.278 0.561 . . . . 0.0 110.996 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -107.15 29.92 6.67 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.16 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.55 115.95 3.79 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.445 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -87.69 123.46 32.55 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 80.4 m -134.83 139.76 45.32 Favored 'General case' 0 N--CA 1.439 -0.993 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.541 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.595 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 1.2 pm0 -70.03 145.18 51.93 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.193 176.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 89' ' ' SER . 36.4 ttpt -72.25 -42.47 65.62 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.225 -176.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.2 t -152.44 148.19 27.15 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 118.512 -1.275 . . . . 0.0 113.019 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.3 m -131.88 149.35 32.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.88 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 11.3 t -114.08 139.61 49.16 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 114.238 -1.346 . . . . 0.0 109.12 177.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 13.3 mt -131.03 138.31 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.118 0 CA-C-O 120.917 0.389 . . . . 0.0 111.015 -173.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.7 t -130.09 128.9 42.8 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.03 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -136.09 129.32 17.95 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.294 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -67.84 113.65 3.07 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 121.086 1.19 . . . . 0.0 110.61 175.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 50.7 t -81.3 67.41 7.23 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -175.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 55.1 -129.06 45.21 Favored Glycine 0 C--O 1.239 0.425 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.708 177.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 42.8 mttp 57.18 46.07 19.5 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 121.714 0.769 . . . . 0.0 110.589 179.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 48.3 tp 57.36 86.55 0.07 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 113.706 -1.588 . . . . 0.0 111.199 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 16.4 p -77.04 115.3 16.7 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.785 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -139.47 82.58 18.4 Favored Pre-proline 0 C--N 1.312 -1.031 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.62 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -71.15 -75.31 0.01 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.903 2.402 . . . . 0.0 112.741 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 23.8 pttm 30.06 63.33 0.9 Allowed Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.323 1.049 . . . . 0.0 113.372 -173.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.64 68.13 0.25 Allowed 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 123.248 2.632 . . . . 0.0 113.94 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 72.81 -37.87 0.4 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.001 0.92 . . . . 0.0 113.257 175.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 64.63 67.77 0.55 Allowed 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.454 0.645 . . . . 0.0 110.979 -178.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -83.92 -56.15 3.85 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.298 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 61.1 p -156.93 155.14 30.86 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.353 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -70.88 99.01 1.67 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 9.6 pttm 64.43 169.11 0.18 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.491 1.116 . . . . 0.0 111.515 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -91.57 163.42 14.14 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.398 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -86.97 3.12 47.1 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.257 0.551 . . . . 0.0 110.543 179.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -89.91 -171.49 3.17 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.057 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 69.16 9.51 7.4 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.153 0.581 . . . . 0.0 112.208 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -86.6 68.73 3.23 Favored Glycine 0 N--CA 1.438 -1.174 0 C-N-CA 120.853 -0.689 . . . . 0.0 111.891 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -73.63 109.77 7.4 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -78.81 42.11 0.44 Allowed 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.653 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.496 ' NE2' ' HA ' ' A' ' 22' ' ' VAL . 88.0 mm-40 62.53 -167.89 0.2 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.061 0.544 . . . . 0.0 111.446 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -87.8 121.81 30.68 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.884 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -68.05 107.17 2.61 Favored 'General case' 0 N--CA 1.44 -0.925 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.082 -179.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 66.1 mtt -74.92 123.06 24.4 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.777 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 88.8 mt 68.02 160.58 0.17 Allowed 'General case' 0 C--O 1.239 0.549 0 O-C-N 123.887 0.742 . . . . 0.0 111.793 -179.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 36.5 t70 . . . . . 0 C--N 1.316 -0.882 0 CA-C-O 118.802 -0.618 . . . . 0.0 109.88 -179.531 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.075 0 N-CA-C 111.591 -0.604 . . . . 0.0 111.591 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 58.6 tttp 65.1 99.23 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.173 0.589 . . . . 0.0 111.655 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -83.54 134.37 34.83 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 177.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -61.51 -41.73 97.75 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.556 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.7 tttm 64.39 94.77 0.05 OUTLIER Pre-proline 0 CA--C 1.536 0.44 0 O-C-N 123.844 0.715 . . . . 0.0 111.222 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.22 -94.34 0.01 OUTLIER 'Trans proline' 0 CA--C 1.517 -0.332 0 C-N-CA 122.673 2.249 . . . . 0.0 112.569 -179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 58.06 85.26 0.09 Allowed 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.338 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -113.97 144.13 43.58 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.435 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -62.1 120.49 10.97 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-O 121.207 0.527 . . . . 0.0 111.635 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.9 p -107.8 157.83 7.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.048 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -93.4 -166.75 1.58 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.671 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -65.65 96.51 0.27 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.176 0.512 . . . . 0.0 110.452 177.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.7 p -86.7 142.36 28.24 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.921 -179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 15' ' ' CYS . 38.3 t70 -90.5 115.93 28.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.034 0.445 . . . . 0.0 111.61 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ASP . 34.4 t 171.47 -69.03 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.592 -1.185 . . . . 0.0 108.987 178.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -154.98 155.14 26.02 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 17' ' ' GLU . 1.8 pm0 -86.91 166.92 14.76 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 87.2 m95 -50.63 122.04 6.65 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.988 -1.006 . . . . 0.0 112.389 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -103.51 136.73 42.7 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 176.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -120.83 130.89 54.15 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-O 121.634 0.73 . . . . 0.0 112.425 -175.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.2 t -94.49 171.82 8.57 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 114.502 -1.226 . . . . 0.0 107.845 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.8 m -92.36 142.67 12.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.042 -178.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 49.8 t -66.36 132.43 48.32 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.362 -176.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.4 t -93.11 116.35 66.36 Favored Pre-proline 0 C--N 1.311 -1.102 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 177.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.513 ' O ' ' HB ' ' A' ' 26' ' ' THR . 19.2 Cg_endo -57.62 -23.96 59.89 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 123.169 2.579 . . . . 0.0 113.138 -175.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.513 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 55.5 m 83.01 -41.92 0.1 Allowed 'General case' 0 C--O 1.234 0.238 0 C-N-CA 123.209 0.604 . . . . 0.0 111.091 177.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 t 70.41 -146.56 0.08 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.736 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.403 ' O ' ' HB3' ' A' ' 29' ' ' ASP . . . 64.46 51.5 51.73 Favored Glycine 0 CA--C 1.498 -1.029 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -176.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.403 ' HB3' ' O ' ' A' ' 28' ' ' GLY . 20.8 t70 72.92 -57.72 0.62 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.624 0.77 . . . . 0.0 111.146 -178.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 68.1 m -155.21 96.95 1.87 Allowed 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 123.597 0.759 . . . . 0.0 109.043 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.408 ' H ' HD13 ' A' ' 55' ' ' ILE . . . -120.84 145.85 17.39 Favored Glycine 0 N--CA 1.431 -1.682 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.887 -179.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.7 tp -72.39 109.45 6.1 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.71 155.08 52.76 Favored Glycine 0 N--CA 1.438 -1.181 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.14 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.0 p -135.43 152.27 51.22 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.228 0.537 . . . . 0.0 111.306 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -133.49 149.31 51.73 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -130.37 131.11 45.16 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 120.723 0.297 . . . . 0.0 110.917 -178.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -123.07 144.72 15.86 Favored Glycine 0 N--CA 1.436 -1.353 0 N-CA-C 109.771 -1.331 . . . . 0.0 109.771 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 28.2 p -134.91 153.94 51.87 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 117.429 0.615 . . . . 0.0 111.65 -177.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.444 ' HG2' ' N ' ' A' ' 40' ' ' THR . 22.6 ttt180 -149.53 161.35 42.3 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.511 ' HB ' ' HA ' ' A' ' 44' ' ' CYS . 1.3 p -104.95 154.42 20.12 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 177.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -87.35 -166.53 42.61 Favored Glycine 0 CA--C 1.507 -0.423 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.79 -23.33 58.49 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 118.46 1.13 . . . . 0.0 108.911 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.428 ' HG3' ' HG2' ' A' ' 45' ' ' LYS . 6.7 pt-20 -94.86 7.79 44.81 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.495 -1.23 . . . . 0.0 109.587 176.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.511 ' HA ' ' HB ' ' A' ' 40' ' ' THR . 93.7 m 65.08 30.32 11.67 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.996 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 40' ' ' THR . 32.8 mmtp -80.05 -178.34 6.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.668 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -96.2 109.21 21.71 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.976 0.417 . . . . 0.0 111.904 -174.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 m -109.43 126.38 53.41 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 175.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 27.3 ttt -137.02 153.25 50.69 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -173.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -144.8 135.15 24.27 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.242 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.5 m -116.98 139.04 51.14 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -134.72 152.13 51.52 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.797 0.332 . . . . 0.0 110.6 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.444 ' N ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -105.41 130.91 53.4 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.156 179.249 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 58.1 m -87.91 -168.52 2.24 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 39.3 tttp -124.51 131.47 53.49 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.408 HD13 ' H ' ' A' ' 31' ' ' GLY . 20.1 tt -106.45 118.14 55.36 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 121.014 0.435 . . . . 0.0 110.544 -179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.28 -29.12 3.27 Favored 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.579 2.186 . . . . 0.0 112.91 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 62.1 m 66.52 12.66 8.87 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 122.849 0.459 . . . . 0.0 112.05 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -84.44 145.68 28.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.819 0.343 . . . . 0.0 110.402 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -77.2 99.95 5.62 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.212 0.529 . . . . 0.0 110.85 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -91.27 101.79 14.49 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.258 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -88.25 -96.63 0.09 Allowed 'General case' 0 CA--C 1.498 -1.02 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.249 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 39.5 tt0 -172.56 124.67 0.48 Allowed 'General case' 0 N--CA 1.421 -1.924 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 -178.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -94.56 103.05 15.0 Favored 'General case' 0 C--N 1.3 -1.581 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.297 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 107.07 71.22 0.76 Allowed Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.153 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -129.65 -62.03 0.98 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.056 0.455 . . . . 0.0 110.382 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -83.69 -15.14 49.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.589 0.709 . . . . 0.0 109.525 178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 9.9 p -153.81 -166.14 2.31 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 114.981 -1.009 . . . . 0.0 108.469 -177.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -132.01 147.36 52.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.481 ' CE2' HD23 ' A' ' 90' ' ' LEU . 48.5 m-85 -118.35 151.55 37.52 Favored 'General case' 0 CA--C 1.502 -0.868 0 CA-C-O 121.18 0.514 . . . . 0.0 111.899 -177.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.462 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 48.8 tp60 -114.76 117.66 31.39 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 177.033 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -96.58 141.55 29.71 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -119.03 162.39 18.64 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.099 0.476 . . . . 0.0 109.851 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.3 156.76 44.4 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.156 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -103.99 -11.53 17.36 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 165.12 -147.45 12.53 Favored Glycine 0 N--CA 1.428 -1.839 0 N-CA-C 109.91 -1.276 . . . . 0.0 109.91 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -117.52 113.87 22.62 Favored 'General case' 0 N--CA 1.427 -1.589 0 C-N-CA 120.659 -0.417 . . . . 0.0 110.869 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 14.9 t 60.77 118.25 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 O-C-N 124.049 0.843 . . . . 0.0 111.633 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -68.82 109.97 4.13 Favored 'General case' 0 CA--C 1.499 -0.989 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.9 mt -69.33 -22.29 63.77 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.691 -174.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -66.69 -39.77 88.25 Favored 'General case' 0 N--CA 1.425 -1.675 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.203 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.8 p -107.82 -14.71 14.72 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 69.54 27.17 4.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 122.136 0.97 . . . . 0.0 108.998 -178.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.471 HD22 ' HA ' ' A' ' 108' ' ' PRO . 22.6 mt -127.71 167.44 16.45 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-N 114.218 -1.356 . . . . 0.0 107.978 -178.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.545 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 27.7 ttpt -121.84 136.48 54.93 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.762 -177.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 5.6 m -120.1 145.33 47.0 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 115.175 -0.921 . . . . 0.0 111.565 -175.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -130.32 129.34 43.07 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 176.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.07 138.57 48.55 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.7 152.58 23.14 Favored Glycine 0 N--CA 1.439 -1.131 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.066 -178.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 23.0 t -145.66 146.02 31.14 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 121.026 0.441 . . . . 0.0 110.703 -179.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.61 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.0 tm? -68.11 123.06 19.61 Favored 'General case' 0 N--CA 1.406 -2.632 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.492 176.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.462 ' HD3' ' HB2' ' A' ' 70' ' ' GLN . 59.6 mtmt -85.75 -48.18 9.05 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 120.905 0.383 . . . . 0.0 110.715 -178.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -161.67 144.44 12.03 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.047 179.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -132.99 151.78 52.03 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.429 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tp -83.18 169.85 15.35 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -65.5 -27.4 68.45 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.586 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -105.13 45.74 0.95 Allowed 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.555 0.693 . . . . 0.0 109.41 177.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -150.34 115.16 5.28 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.059 178.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -103.37 117.24 34.03 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.563 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . 0.453 ' HB3' ' OH ' ' A' ' 69' ' ' TYR . 83.8 m -141.05 145.9 36.48 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.068 0.461 . . . . 0.0 111.582 -178.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.61 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 20.1 pm0 -66.76 150.08 49.63 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.377 175.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -76.72 -36.53 57.11 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.198 -173.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.45 ' HA ' ' HA ' ' A' ' 89' ' ' SER . 5.4 t -152.57 149.53 28.58 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 119.296 -0.961 . . . . 0.0 113.378 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 17.0 m -136.39 140.64 43.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.94 178.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 11.0 t -128.85 136.69 50.81 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.507 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 12.9 tt -140.33 140.69 34.29 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 121.159 0.504 . . . . 0.0 111.249 -178.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 18.6 m -120.43 128.46 53.21 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.018 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -131.32 115.78 16.3 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.394 -179.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.471 ' HA ' HD22 ' A' ' 83' ' ' LEU . 77.0 Cg_exo -51.26 127.63 22.73 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.524 2.149 . . . . 0.0 112.078 178.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.545 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 86.0 m -65.68 -50.22 65.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.806 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -175.42 131.65 1.98 Allowed Glycine 0 N--CA 1.438 -1.224 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.666 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -81.96 145.73 30.13 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.5 mp -53.99 126.85 24.07 Favored 'General case' 0 C--O 1.239 0.547 0 O-C-N 123.494 0.496 . . . . 0.0 111.563 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 7.4 p -79.82 169.91 17.26 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.48 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 61.33 71.61 0.77 Allowed Pre-proline 0 N--CA 1.467 0.396 0 O-C-N 123.408 0.442 . . . . 0.0 110.203 -177.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -57.36 -76.74 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.946 2.431 . . . . 0.0 113.063 -178.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp 41.09 62.99 6.25 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.269 0.628 . . . . 0.0 112.043 -176.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -52.17 141.05 49.83 Favored 'Trans proline' 0 C--N 1.362 1.269 0 C-N-CA 122.543 2.162 . . . . 0.0 111.264 176.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -62.67 118.55 7.8 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.325 0.583 . . . . 0.0 110.92 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -159.93 142.01 13.15 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.071 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -60.98 122.13 14.15 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 177.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 39.6 m -77.56 35.04 0.18 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.14 0.495 . . . . 0.0 111.901 -176.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -124.62 162.12 24.79 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -77.92 90.2 4.13 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.136 0.493 . . . . 0.0 111.303 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -90.94 154.24 19.6 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.931 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt 66.88 99.15 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 O-C-N 123.76 0.663 . . . . 0.0 111.135 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -82.88 179.67 7.7 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.363 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -71.42 96.13 1.44 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.988 0.423 . . . . 0.0 111.672 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -85.14 45.67 3.55 Favored Glycine 0 N--CA 1.45 -0.408 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 176.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -142.58 156.03 45.06 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 -177.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -157.29 92.82 1.27 Allowed 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 120.96 0.409 . . . . 0.0 110.142 176.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -78.93 105.29 10.16 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.175 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -60.8 -35.85 77.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.491 -177.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -147.06 159.82 43.13 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -75.61 127.0 32.11 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 64.1 tp 73.99 130.33 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.538 0 O-C-N 124.122 0.889 . . . . 0.0 111.14 -177.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 33.9 t70 . . . . . 0 C--O 1.255 1.362 0 C-N-CA 123.625 0.77 . . . . 0.0 111.317 -179.462 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.101 0 N-CA-C 111.928 -0.469 . . . . 0.0 111.928 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.41 ' NZ ' ' HB2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -141.83 17.49 2.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.708 0.254 . . . . 0.0 111.361 -179.608 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -81.66 156.11 25.26 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 120.824 0.345 . . . . 0.0 110.949 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -77.59 91.34 3.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.375 -177.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -149.32 93.52 4.09 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-O 121.013 0.435 . . . . 0.0 110.619 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -99.1 -136.66 0.01 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 123.5 2.8 . . . . 0.0 110.886 178.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -110.11 108.66 18.92 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.327 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -76.85 -21.67 54.66 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 86.2 tttt 64.08 121.55 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 114.524 -1.216 . . . . 0.0 113.257 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.3 p -85.26 151.96 3.68 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.772 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -85.78 43.89 1.07 Allowed 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.431 0.634 . . . . 0.0 111.265 -176.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -131.2 149.31 52.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.143 178.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.6 p -80.05 92.11 5.57 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.035 0.445 . . . . 0.0 110.24 178.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.85 106.77 17.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.135 -177.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.49 ' HA ' ' HB ' ' A' ' 40' ' ' THR . 1.3 m 59.96 91.9 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.586 176.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -134.48 177.58 19.1 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.495 -0.859 . . . . 0.0 113.067 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.57 ' CD ' ' H ' ' A' ' 17' ' ' GLU . 1.4 pm0 -85.45 170.66 12.46 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 123.791 0.836 . . . . 0.0 111.438 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.541 ' HA ' ' O ' ' A' ' 38' ' ' THR . 66.1 m95 -46.77 119.86 2.69 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.692 0.758 . . . . 0.0 112.888 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 93.5 mt-30 -116.1 115.12 25.5 Favored 'General case' 0 N--CA 1.434 -1.273 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 175.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -101.13 146.55 27.33 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -175.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.0 t -91.98 174.98 7.04 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 114.53 -1.213 . . . . 0.0 109.334 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.9 m -93.13 153.46 3.33 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.282 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.325 -175.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.437 ' SG ' ' HD3' ' A' ' 35' ' ' ARG . 34.0 m -84.23 112.04 19.92 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.785 -176.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.48 ' O ' ' HA3' ' A' ' 33' ' ' GLY . 6.9 m -106.86 102.76 44.15 Favored Pre-proline 0 N--CA 1.435 -1.201 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 174.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.544 ' O ' ' HB ' ' A' ' 26' ' ' THR . 26.3 Cg_endo -62.18 -16.55 51.43 Favored 'Trans proline' 0 C--O 1.218 -0.484 0 C-N-CA 122.839 2.359 . . . . 0.0 112.553 -176.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.544 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 51.9 m 81.62 -14.53 0.79 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 122.544 1.164 . . . . 0.0 108.875 177.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.503 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 16.7 t -142.37 -145.46 0.17 Allowed 'General case' 0 N--CA 1.411 -2.414 0 CA-C-N 113.767 -1.561 . . . . 0.0 109.113 -178.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -151.93 -42.25 0.02 OUTLIER Glycine 0 CA--C 1.482 -2.023 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -102.98 66.54 0.92 Allowed 'General case' 0 C--N 1.307 -1.24 0 CA-C-O 121.38 0.61 . . . . 0.0 110.797 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.2 m 75.29 76.43 0.1 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.463 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.503 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -127.89 154.94 19.98 Favored Glycine 0 N--CA 1.44 -1.04 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 177.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.469 HD21 HH11 ' A' ' 52' ' ' ARG . 55.7 tp -83.76 125.42 31.89 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.739 0.269 . . . . 0.0 110.893 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.48 ' HA3' ' O ' ' A' ' 24' ' ' VAL . . . -139.17 164.74 25.83 Favored Glycine 0 CA--C 1.505 -0.564 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 -177.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 6.8 m -145.69 154.92 42.62 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 -174.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.437 ' HD3' ' SG ' ' A' ' 23' ' ' CYS . 23.5 ptt180 -134.9 154.32 51.72 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.759 176.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.444 ' HG2' HG22 ' A' ' 50' ' ' THR . 25.3 mt-10 -115.96 131.72 56.86 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.148 -177.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -122.46 151.07 16.89 Favored Glycine 0 CA--C 1.52 0.357 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.541 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 14.2 p -134.32 155.03 50.96 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.429 0.614 . . . . 0.0 111.471 -177.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.539 ' HG2' ' N ' ' A' ' 40' ' ' THR . 17.5 ttt180 -151.49 160.47 43.69 Favored 'General case' 0 C--O 1.217 -0.609 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.596 HG22 ' HA ' ' A' ' 44' ' ' CYS . 0.2 OUTLIER -133.71 155.34 49.92 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 174.908 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -106.39 -152.11 19.35 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 111.095 -0.802 . . . . 0.0 111.095 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.58 -33.63 53.86 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 117.062 0.431 . . . . 0.0 111.649 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -84.94 1.68 46.25 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -177.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.596 ' HA ' HG22 ' A' ' 40' ' ' THR . 66.4 m 57.78 32.87 22.52 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.873 0.368 . . . . 0.0 111.422 -178.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -68.36 -23.54 64.7 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.312 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 72.25 105.46 0.07 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.635 0.731 . . . . 0.0 112.278 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 m -105.15 145.11 31.02 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.269 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 26.0 ttt -139.54 148.25 42.34 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.555 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -143.35 136.34 27.78 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.444 HG22 ' HG2' ' A' ' 36' ' ' GLU . 13.0 p -116.62 135.9 53.41 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 55.7 tp60 -137.86 138.24 38.9 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 120.364 -0.535 . . . . 0.0 111.386 -177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.469 HH11 HD21 ' A' ' 32' ' ' LEU . 39.6 mtt180 -87.37 131.5 34.26 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 177.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 85.4 m -82.36 160.64 22.77 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -113.69 135.38 54.0 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-O 121.259 0.552 . . . . 0.0 112.113 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 31' ' ' GLY . 4.0 mp -111.16 126.22 29.08 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.751 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -70.08 103.18 1.18 Allowed 'Trans proline' 0 C--O 1.236 0.421 0 C-N-CA 122.487 2.125 . . . . 0.0 111.349 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 4.6 t -99.55 176.13 5.59 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.213 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -71.92 145.35 48.53 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.862 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 35.0 p90 -84.25 165.37 18.41 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.807 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -129.21 173.05 10.84 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.899 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.01 127.78 33.82 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.434 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -123.97 35.42 4.84 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.387 0.613 . . . . 0.0 109.813 -176.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -71.41 -17.19 62.41 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.378 -178.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.45 102.53 2.6 Favored Glycine 0 C--N 1.302 -1.314 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.243 -177.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.5 -32.88 74.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.625 0.25 . . . . 0.0 111.625 -178.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -84.76 -13.4 51.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.968 0.413 . . . . 0.0 111.027 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 82.0 m -81.91 158.86 23.8 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.704 ' O ' ' HA ' ' A' ' 90' ' ' LEU . 47.6 mtpt -128.19 127.68 43.37 Favored 'General case' 0 CA--C 1.498 -1.025 0 C-N-CA 119.631 -0.828 . . . . 0.0 110.896 -176.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 100' ' ' GLN . 79.0 m-85 -124.8 129.33 50.24 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.894 -175.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -112.07 129.75 56.11 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -94.14 135.7 35.24 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.979 0.419 . . . . 0.0 110.924 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.444 HE21 ' HB ' ' A' ' 87' ' ' THR . 7.1 pt20 -108.19 162.97 13.58 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.916 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -130.65 92.27 3.22 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.713 -177.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 43.0 p-90 -92.45 -18.07 23.71 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.525 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -167.27 110.77 0.41 Allowed Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.991 -0.843 . . . . 0.0 110.991 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -95.53 115.84 28.0 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-O 120.792 0.329 . . . . 0.0 111.774 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.622 ' H ' ' HG3' ' A' ' 84' ' ' LYS . 13.5 t 60.76 107.72 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.744 -1.116 . . . . 0.0 112.428 175.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.55 ' OD2' HG22 ' A' ' 81' ' ' THR . 27.3 t70 -82.16 131.16 35.24 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.789 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.8 mt -72.39 -32.41 66.37 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 115.8 -0.637 . . . . 0.0 112.559 -176.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -69.13 -42.42 76.04 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.288 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.568 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 10.0 t -105.99 -1.61 23.79 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -175.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 55.06 32.47 18.32 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -178.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 81' ' ' THR . 24.0 mt -127.1 164.33 21.82 Favored 'General case' 0 CA--C 1.497 -1.081 0 O-C-N 121.845 -0.535 . . . . 0.0 110.143 -178.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.622 ' HG3' ' H ' ' A' ' 77' ' ' CYS . 77.5 tttt -120.64 136.68 54.76 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -177.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 4.2 m -119.35 144.24 46.97 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.567 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -139.48 141.19 37.4 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.089 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.444 ' HB ' HE21 ' A' ' 72' ' ' GLN . 14.2 m -120.93 145.5 47.63 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.091 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -144.55 157.16 27.14 Favored Glycine 0 N--CA 1.443 -0.849 0 N-CA-C 111.713 -0.555 . . . . 0.0 111.713 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.9 m -145.61 149.64 34.89 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.62 0.21 . . . . 0.0 111.206 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.768 HD12 ' HA ' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -69.46 129.97 41.2 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.003 0.43 . . . . 0.0 110.219 177.595 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -92.65 -32.72 14.65 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 120.906 0.384 . . . . 0.0 110.91 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.94 143.93 31.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -134.65 145.46 48.6 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.71 0.291 . . . . 0.0 110.822 -176.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.7 mp -91.4 174.73 7.22 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.233 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -88.95 -17.25 29.88 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.105 0.478 . . . . 0.0 110.833 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -101.86 28.03 6.03 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.274 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -164.01 117.79 1.47 Allowed 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.983 -176.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -82.03 111.27 18.03 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 174.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 80.4 m -94.3 165.21 12.7 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.37 0.605 . . . . 0.0 112.262 -175.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.497 ' O ' ' HB3' ' A' ' 90' ' ' LEU . 88.4 mt-30 -87.04 124.62 33.41 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.251 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.768 ' HA ' HD12 ' A' ' 90' ' ' LEU . 20.1 pttm -74.79 -31.96 61.88 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.412 -178.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.9 t -158.88 149.22 19.63 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-O 121.463 0.649 . . . . 0.0 111.389 175.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 13.7 m -141.5 139.47 32.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.063 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 88.5 m -129.04 131.67 47.38 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.108 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 22.4 pt -135.47 145.63 31.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 CA-C-O 120.625 0.25 . . . . 0.0 110.453 -177.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 84' ' ' LYS . 6.5 p -122.55 134.38 54.54 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.872 179.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -126.03 132.32 24.27 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.888 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.42 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 30.8 Cg_endo -64.03 124.47 13.56 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 122.049 1.833 . . . . 0.0 112.233 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 94.9 m -73.12 -17.85 61.35 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.235 0.541 . . . . 0.0 109.822 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -145.96 160.16 28.08 Favored Glycine 0 N--CA 1.433 -1.536 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 178.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.7 mttm 65.08 83.21 0.17 Allowed 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.646 0.736 . . . . 0.0 111.017 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 87.7 mt -81.18 97.49 7.62 Favored 'General case' 0 C--N 1.308 -1.214 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.59 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 10.9 p -94.05 154.55 17.57 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.316 -179.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 57.4 pttt 40.88 75.83 0.56 Allowed Pre-proline 0 N--CA 1.484 1.233 0 C-N-CA 124.169 0.987 . . . . 0.0 113.287 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -68.29 146.12 68.23 Favored 'Trans proline' 0 C--O 1.238 0.52 0 C-N-CA 122.666 2.244 . . . . 0.0 112.433 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -69.44 -47.5 26.52 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.069 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -79.46 88.6 1.43 Allowed 'Trans proline' 0 C--N 1.369 1.634 0 C-N-CA 121.947 1.765 . . . . 0.0 111.46 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -88.81 2.88 52.83 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.917 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 66.07 114.67 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.871 0.732 . . . . 0.0 111.75 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -76.71 84.94 3.34 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 121.136 0.493 . . . . 0.0 110.058 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 27.1 p -80.58 -6.84 58.87 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.312 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -61.01 121.24 11.93 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.464 178.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -65.23 -27.44 68.67 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.975 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 83.2 tttt 63.1 47.52 4.15 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.829 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt 61.09 50.18 5.15 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.786 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 97.3 mttt 66.26 -168.62 0.2 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.654 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -62.28 150.58 38.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.958 179.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -87.95 -61.6 1.49 Allowed Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.87 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -128.18 152.49 47.98 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.986 0.422 . . . . 0.0 110.825 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -110.27 88.08 2.67 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.411 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 44.7 tt0 -121.46 129.42 52.96 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.866 -174.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 131' ' ' GLN . 10.2 pt-20 49.09 15.46 0.11 Allowed 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 125.431 1.493 . . . . 0.0 115.003 175.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.7 mttm 62.04 -178.32 0.13 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.282 0.563 . . . . 0.0 111.219 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 65.9 mtt -91.1 101.8 14.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.945 0.402 . . . . 0.0 109.95 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 94.4 mt -97.4 -176.31 3.47 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.375 -179.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.416 -0.802 . . . . 0.0 109.582 178.327 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.246 0 N-CA-C 111.766 -0.534 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -89.49 4.75 48.18 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -177.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -65.43 -27.87 68.83 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.547 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 60.96 -172.22 0.14 Allowed 'General case' 0 C--O 1.239 0.505 0 O-C-N 123.426 0.454 . . . . 0.0 110.59 -176.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.1 mttm 48.79 79.89 0.32 Allowed Pre-proline 0 N--CA 1.471 0.582 0 C-N-CA 123.61 0.764 . . . . 0.0 112.718 175.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -93.16 -140.15 0.02 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 122.875 2.383 . . . . 0.0 110.536 178.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -107.41 39.08 1.97 Allowed 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.299 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 mttp 54.5 26.18 6.93 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.563 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -65.9 126.81 29.7 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.436 -178.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.9 p -93.96 165.61 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.799 177.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -84.84 164.03 18.69 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.24 -179.5 3.39 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.231 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.1 m -52.45 95.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -176.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -115.12 135.14 54.52 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.014 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.3 p -109.6 19.58 19.07 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -178.53 131.29 1.7 Allowed Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.034 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -107.83 164.55 12.15 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -56.98 123.55 15.54 Favored 'General case' 0 N--CA 1.427 -1.592 0 O-C-N 123.528 0.518 . . . . 0.0 111.109 173.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.571 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 74.3 mt-30 -115.95 115.45 26.19 Favored 'General case' 0 C--N 1.309 -1.194 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -104.26 143.61 32.73 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 t -104.38 171.59 7.25 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.87 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 28.8 m -94.61 154.82 3.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.6 t -56.16 114.15 1.84 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.325 -178.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 10.5 m -109.99 120.81 43.63 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.989 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.97 129.58 19.87 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 122.786 2.324 . . . . 0.0 113.731 -177.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.485 ' HB ' ' O ' ' A' ' 32' ' ' LEU . 94.9 m -77.75 -22.51 50.17 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.227 176.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.585 ' HB3' ' HA3' ' A' ' 31' ' ' GLY . 17.9 t -159.71 116.91 2.62 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.65 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.9 -32.73 80.79 Favored Glycine 0 C--N 1.33 0.243 0 CA-C-N 115.746 -0.661 . . . . 0.0 113.088 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -76.38 52.68 0.79 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.566 0.222 . . . . 0.0 111.371 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.491 ' HA ' HD13 ' A' ' 55' ' ' ILE . 42.5 t 65.95 80.98 0.21 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.141 179.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.585 ' HA3' ' HB3' ' A' ' 27' ' ' SER . . . -148.87 157.11 27.14 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.3 -0.952 . . . . 0.0 114.191 -177.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.485 ' O ' ' HB ' ' A' ' 26' ' ' THR . 4.3 mm? -49.26 158.42 0.38 Allowed 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 124.465 1.106 . . . . 0.0 112.459 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -135.1 176.71 19.85 Favored Glycine 0 N--CA 1.434 -1.496 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -178.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.4 p -140.35 156.19 46.51 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 118.24 1.02 . . . . 0.0 113.049 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 70.9 mtt-85 -135.62 138.47 42.94 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.749 -1.114 . . . . 0.0 108.542 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -124.85 131.31 53.45 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 120.858 0.361 . . . . 0.0 111.583 -177.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.571 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -133.42 137.33 9.27 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.6 p -132.04 152.8 50.96 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 117.439 0.619 . . . . 0.0 111.083 -177.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.41 ' HG2' ' N ' ' A' ' 40' ' ' THR . 68.7 ttt180 -155.17 160.77 41.16 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.41 ' N ' ' HG2' ' A' ' 39' ' ' ARG . 6.2 p -117.88 161.85 19.08 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 177.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.42 ' H ' ' N ' ' A' ' 45' ' ' LYS . . . -81.11 -173.03 47.15 Favored Glycine 0 C--N 1.322 -0.248 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.222 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.79 -33.47 72.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.983 0.42 . . . . 0.0 110.983 -178.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -97.7 18.12 16.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.497 0.665 . . . . 0.0 109.414 176.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 72.4 m 69.06 60.04 0.34 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.954 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.469 ' HG3' ' H ' ' A' ' 46' ' ' GLN . 14.4 tptm -77.6 -145.87 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.814 176.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.469 ' H ' ' HG3' ' A' ' 45' ' ' LYS . 52.2 tt0 -150.1 116.09 5.64 Favored 'General case' 0 N--CA 1.412 -2.342 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 -178.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.0 m -133.47 122.18 23.28 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 57.0 mtm -129.0 134.97 48.36 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.912 0.387 . . . . 0.0 111.114 -177.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -132.25 130.33 40.79 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.541 177.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.5 p -130.8 131.3 44.58 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 176.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -124.93 141.97 51.77 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 121.105 0.478 . . . . 0.0 110.231 -176.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -85.45 110.72 19.37 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 122.451 1.12 . . . . 0.0 112.232 -177.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.2 t -68.66 147.23 52.18 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 113.063 -1.88 . . . . 0.0 109.867 175.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.0 tttm -114.07 142.14 46.57 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-O 120.753 0.311 . . . . 0.0 110.552 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.491 HD13 ' HA ' ' A' ' 30' ' ' CYS . 17.9 tt -97.91 130.89 27.76 Favored Pre-proline 0 C--N 1.308 -1.197 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -51.0 -52.65 8.64 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.974 2.449 . . . . 0.0 112.242 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 6.3 t 70.73 177.08 0.27 Allowed 'General case' 0 CA--C 1.536 0.44 0 O-C-N 123.764 0.665 . . . . 0.0 110.886 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -84.27 138.29 33.01 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.445 -178.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 73.1 m95 46.04 65.87 1.07 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.95 0.781 . . . . 0.0 111.383 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.3 pttt -90.8 142.86 27.32 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.953 -177.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -103.96 135.52 45.33 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 172.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -153.26 15.4 0.53 Allowed 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 121.748 0.785 . . . . 0.0 109.742 -174.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -98.59 93.19 5.99 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.517 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -83.37 -15.38 71.66 Favored Glycine 0 C--N 1.314 -0.664 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.634 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 62.55 15.69 8.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.047 0.539 . . . . 0.0 111.719 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -84.25 -5.63 59.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.363 0.601 . . . . 0.0 110.293 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 50.0 m -136.52 -160.68 1.08 Allowed 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -127.11 137.05 52.92 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 118.047 0.385 . . . . 0.0 110.134 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -123.26 150.24 43.75 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.995 -178.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.9 tm0? -125.51 125.43 43.25 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 175.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -94.18 131.43 39.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.199 0.523 . . . . 0.0 112.141 -176.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -97.25 163.79 12.76 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.84 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -126.66 79.32 1.86 Allowed 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.109 -178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 42.2 t-105 -82.32 -26.31 33.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.238 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -143.78 157.14 26.95 Favored Glycine 0 N--CA 1.436 -1.345 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.574 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -96.32 147.92 23.3 Favored 'General case' 0 N--CA 1.437 -1.113 0 C-N-CA 123.167 0.587 . . . . 0.0 110.15 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 40.5 t -30.63 137.38 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 O-C-N 124.203 0.939 . . . . 0.0 111.428 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -77.85 122.04 24.92 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 121.516 0.674 . . . . 0.0 109.841 -176.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.8 mt -70.7 -33.12 70.55 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 114.609 -1.178 . . . . 0.0 112.091 -173.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -71.67 -37.49 70.76 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.496 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.513 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 68.1 p -104.32 -8.01 19.57 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -172.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 57.27 34.5 24.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.275 0.56 . . . . 0.0 110.528 -175.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 81' ' ' THR . 44.1 mt -126.98 147.3 50.12 Favored 'General case' 0 CA--C 1.496 -1.11 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.094 -178.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.752 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 81.4 tttt -124.77 137.26 54.33 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.703 -178.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 52.3 m -119.12 143.76 47.0 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 -134.73 140.55 46.03 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 6.0 m -109.81 143.72 39.26 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -136.39 167.28 24.52 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 120.462 -0.875 . . . . 0.0 111.393 -178.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 5.8 p -135.22 144.28 46.83 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 120.626 0.25 . . . . 0.0 110.7 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.599 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 2.9 tm? -70.76 122.87 20.66 Favored 'General case' 0 N--CA 1.409 -2.492 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -97.35 -37.54 9.99 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.957 0.408 . . . . 0.0 110.853 -177.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -155.64 135.06 12.4 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.234 178.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -126.18 144.78 50.63 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 178.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 42.9 mt -87.24 174.39 8.62 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.394 0.616 . . . . 0.0 111.535 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -73.64 -26.7 60.89 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.48 -178.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -105.05 35.94 2.64 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.613 0.72 . . . . 0.0 109.495 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -154.11 134.57 13.47 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.921 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -112.31 122.46 47.79 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 70.7 m -139.72 141.31 36.92 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 121.205 0.526 . . . . 0.0 111.599 -178.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.599 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 3.0 pm0 -68.72 154.27 42.26 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.81 176.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.4 pttm -74.07 -26.55 60.45 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.555 -175.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.5 t -140.63 150.95 44.2 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.324 -0.55 . . . . 0.0 111.665 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 15.8 m -138.87 149.48 23.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.24 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 97.2 m -129.24 136.61 50.33 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.42 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.2 tt -140.7 141.31 32.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 120.84 0.352 . . . . 0.0 110.614 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 57.6 m -121.16 134.8 55.23 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -134.27 133.94 22.24 Favored Pre-proline 0 C--N 1.313 -0.983 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.429 -178.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.43 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 32.7 Cg_exo -58.12 131.03 40.93 Favored 'Trans proline' 0 C--O 1.244 0.777 0 C-N-CA 121.924 1.75 . . . . 0.0 111.504 175.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.752 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 69.8 m -81.77 173.55 12.18 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.325 0.583 . . . . 0.0 111.576 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 168.18 -147.9 12.03 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -87.69 77.47 8.66 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.669 0.747 . . . . 0.0 110.635 178.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -131.98 166.58 21.36 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 114.535 -1.211 . . . . 0.0 110.186 -179.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.471 ' O ' ' HD3' ' A' ' 115' ' ' PRO . 13.5 p -82.39 -178.35 7.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.3 177.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -114.48 86.32 12.24 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-O 120.725 0.297 . . . . 0.0 110.775 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.471 ' HD3' ' O ' ' A' ' 113' ' ' THR . 33.7 Cg_exo -63.82 136.56 53.89 Favored 'Trans proline' 0 C--O 1.24 0.615 0 C-N-CA 122.754 2.302 . . . . 0.0 113.271 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.543 ' N ' ' HD3' ' A' ' 117' ' ' PRO . 19.2 pttp -155.49 53.8 0.88 Allowed Pre-proline 0 C--N 1.306 -1.313 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.233 175.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.543 ' HD3' ' N ' ' A' ' 116' ' ' LYS . 42.0 Cg_exo -56.89 102.3 0.11 Allowed 'Trans proline' 0 C--N 1.372 1.776 0 C-N-CA 122.731 2.288 . . . . 0.0 113.366 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 68.97 127.77 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.377 0.881 . . . . 0.0 113.377 177.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -135.64 115.92 13.5 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.548 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 123' ' ' LYS . 29.7 mt-10 -67.64 108.18 2.81 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.846 0.355 . . . . 0.0 110.819 -178.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 12.0 m -96.87 -24.55 15.82 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.074 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -92.47 -28.4 16.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.952 -179.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.485 ' HB2' ' HB3' ' A' ' 120' ' ' GLU . 40.9 mmtm -85.83 88.2 7.52 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.176 0.512 . . . . 0.0 110.211 177.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -82.83 -42.38 17.91 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.362 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 54.3 tptt 60.84 -78.4 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.803 0.841 . . . . 0.0 112.003 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 57.4 tttp 62.87 -79.43 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.885 0.874 . . . . 0.0 110.519 -176.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 66.18 168.7 0.22 Allowed 'General case' 0 C--O 1.237 0.441 0 C-N-CA 123.926 0.89 . . . . 0.0 112.658 176.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -167.76 -96.27 0.11 Allowed Glycine 0 N--CA 1.433 -1.532 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 178.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 58.8 mttp 50.07 78.03 0.11 Allowed 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.076 0.55 . . . . 0.0 112.342 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -69.93 87.95 0.56 Allowed 'General case' 0 N--CA 1.434 -1.273 0 CA-C-O 121.158 0.504 . . . . 0.0 109.753 177.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -55.8 -64.16 0.94 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.806 -178.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -157.07 131.25 8.42 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.473 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 23.7 ttpp -153.03 72.2 0.94 Allowed 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 28.0 ttt -80.27 128.8 33.96 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.553 -177.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 50.1 tp -140.06 102.66 4.44 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 C--N 1.311 -1.102 0 CA-C-O 118.287 -0.863 . . . . 0.0 111.354 -175.883 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.947 0 N-CA-C 111.459 -0.657 . . . . 0.0 111.459 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -113.92 -178.68 3.43 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 120.697 0.284 . . . . 0.0 110.51 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 4' ' ' GLU . 20.9 pttp -149.7 19.13 0.91 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.911 -176.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 3' ' ' LYS . 39.4 tt0 71.28 132.14 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -172.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 66.1 tttp 62.28 81.41 0.23 Allowed Pre-proline 0 C--O 1.238 0.46 0 CA-C-O 121.218 0.532 . . . . 0.0 109.66 -176.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.421 ' HG2' ' H ' ' A' ' 7' ' ' GLU . 59.8 Cg_endo -73.78 -88.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.512 -0.616 0 C-N-CA 122.731 2.287 . . . . 0.0 113.034 -178.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.421 ' H ' ' HG2' ' A' ' 6' ' ' PRO . 39.5 mt-10 60.42 68.58 0.75 Allowed 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.09 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -143.06 118.13 10.07 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.23 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -82.92 130.19 35.11 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.397 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 p -119.88 142.22 36.41 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.394 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.742 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 58.0 mtpt -127.89 153.01 47.14 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.653 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -88.42 100.84 13.34 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 177.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.8 m -150.66 -159.81 1.08 Allowed 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.548 -177.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -76.1 165.57 24.73 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 58.2 m 57.71 87.34 0.07 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.172 0.511 . . . . 0.0 110.907 -176.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -147.06 179.02 24.31 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.878 -177.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -76.2 169.66 17.79 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 122.93 0.492 . . . . 0.0 111.253 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.522 ' HA ' ' O ' ' A' ' 38' ' ' THR . 81.6 m95 -48.57 118.93 2.75 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.417 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.453 ' O ' ' HA2' ' A' ' 37' ' ' GLY . 6.8 pt20 -120.14 115.44 23.66 Favored 'General case' 0 N--CA 1.436 -1.173 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 89.7 m95 -100.8 146.41 27.32 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.803 -175.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 m -94.53 171.8 8.58 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 114.79 -1.095 . . . . 0.0 108.998 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.5 m -91.93 154.79 3.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -177.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.8 t -74.45 116.47 15.16 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.805 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.0 t -111.44 117.87 48.39 Favored Pre-proline 0 N--CA 1.434 -1.246 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 179.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.32 143.66 75.26 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.533 2.155 . . . . 0.0 112.373 -179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.436 ' HB ' ' O ' ' A' ' 32' ' ' LEU . 23.7 m -90.3 -23.8 21.06 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.354 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.4 t -134.62 173.63 11.45 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.074 179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -67.94 74.57 0.25 Allowed Glycine 0 N--CA 1.448 -0.565 0 O-C-N 123.683 0.614 . . . . 0.0 113.617 -177.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.7 t70 68.93 23.87 6.56 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-O 121.9 0.857 . . . . 0.0 110.826 174.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.502 ' HA ' ' HB2' ' A' ' 57' ' ' CYS . 9.0 t -150.92 10.35 0.61 Allowed 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.619 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.482 ' O ' HG13 ' A' ' 55' ' ' ILE . . . -126.51 126.1 5.62 Favored Glycine 0 CA--C 1.494 -1.229 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.539 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 53' ' ' CYS . 1.2 mp -51.64 152.4 2.81 Favored 'General case' 0 C--O 1.207 -1.158 0 O-C-N 124.176 0.574 . . . . 0.0 111.483 -179.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.07 -175.19 14.79 Favored Glycine 0 CA--C 1.496 -1.154 0 N-CA-C 109.936 -1.266 . . . . 0.0 109.936 -173.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.2 p -136.8 154.14 50.62 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 117.816 0.808 . . . . 0.0 112.207 -179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -126.23 137.63 53.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 175.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -113.9 131.41 56.3 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.569 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.453 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -137.7 141.7 12.51 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.116 -0.794 . . . . 0.0 111.116 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.522 ' O ' ' HA ' ' A' ' 18' ' ' TRP . 22.8 p -123.79 154.78 39.06 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.954 0.377 . . . . 0.0 110.658 -179.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.522 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 9.4 tpt180 -145.18 159.95 42.21 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.403 ' OG1' ' HA ' ' A' ' 44' ' ' CYS . 11.1 t -115.84 162.22 17.63 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-O 122.173 0.987 . . . . 0.0 112.225 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.41 -164.15 11.23 Favored Glycine 0 C--N 1.286 -2.24 0 CA-C-N 113.432 -1.713 . . . . 0.0 108.839 175.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.17 -25.97 66.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 118.254 1.027 . . . . 0.0 111.872 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -99.73 -11.34 20.94 Favored 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 120.182 -0.607 . . . . 0.0 111.364 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.403 ' HA ' ' OG1' ' A' ' 40' ' ' THR . 93.8 m 68.29 152.17 0.09 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptp 63.25 10.8 4.9 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.832 175.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -103.57 18.12 22.57 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.42 ' HB ' ' O ' ' A' ' 39' ' ' ARG . 11.9 m -143.62 110.44 5.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.549 0.69 . . . . 0.0 112.01 178.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 24.2 ttt -146.23 135.11 22.46 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.045 177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.7 mmtm -143.05 142.76 31.64 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.12 0.486 . . . . 0.0 111.397 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.1 m -118.4 136.58 53.68 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.08 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 54.4 tp60 -128.73 141.19 51.4 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 110.264 -0.272 . . . . 0.0 110.264 -177.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 84.1 mtt180 -86.91 139.49 30.58 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.441 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 1.5 p -99.96 -170.18 1.85 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -113.49 138.42 50.15 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.655 0.264 . . . . 0.0 110.75 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 31' ' ' GLY . 22.0 mm -126.69 111.15 22.63 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.273 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.76 122.92 9.59 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.569 2.179 . . . . 0.0 111.411 177.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.502 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 42.6 t -124.34 157.08 35.86 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.663 0.268 . . . . 0.0 110.986 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -67.28 146.76 53.81 Favored 'General case' 0 C--O 1.244 0.783 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.245 177.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -59.71 153.4 20.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.262 0.553 . . . . 0.0 112.05 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -92.37 -164.66 1.21 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.549 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.415 ' N ' ' HD2' ' A' ' 61' ' ' LYS . 9.8 mptt -84.4 141.99 30.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.796 -178.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -144.26 100.45 3.55 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -109.65 18.15 20.57 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.11 0.481 . . . . 0.0 111.262 -177.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 139.89 171.95 12.56 Favored Glycine 0 N--CA 1.445 -0.727 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.457 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.06 -56.89 2.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.017 0.436 . . . . 0.0 110.596 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -89.17 -19.72 25.12 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.879 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 99.0 m -80.72 116.52 20.77 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.539 176.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -112.98 130.33 56.17 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.696 ' CE1' HD23 ' A' ' 90' ' ' LEU . 4.6 m-85 -106.58 152.36 23.82 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.374 -177.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.447 ' O ' ' HA2' ' A' ' 88' ' ' GLY . 6.4 tp-100 -103.34 117.05 33.61 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 174.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -94.52 118.74 32.14 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -175.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -122.34 162.97 20.55 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.373 177.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.52 141.63 28.47 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-O 120.972 0.415 . . . . 0.0 111.037 -176.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 40.6 t-105 -97.65 -5.3 35.67 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 148.85 -170.57 29.25 Favored Glycine 0 N--CA 1.427 -1.94 0 CA-C-N 114.752 -1.113 . . . . 0.0 111.873 179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -95.68 148.48 22.5 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 124.04 0.936 . . . . 0.0 109.09 179.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 13.8 m -22.98 125.18 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.358 0 O-C-N 124.225 0.953 . . . . 0.0 112.447 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -80.33 120.46 24.41 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.1 mt -70.22 -28.33 65.18 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.304 -0.862 . . . . 0.0 112.302 -174.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -70.7 -37.38 73.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.029 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.611 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.5 p -105.37 -9.41 17.59 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -174.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 58.98 25.72 14.16 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.422 0.689 . . . . 0.0 110.972 -175.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 81' ' ' THR . 13.9 mt -126.86 162.41 25.95 Favored 'General case' 0 CA--C 1.5 -0.968 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.49 -177.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.623 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 34.9 ttpt -118.93 147.84 43.59 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.1 m -119.27 142.48 48.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.841 0.353 . . . . 0.0 110.479 -176.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.0 tpt180 -135.22 141.03 45.73 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -178.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 94.7 m -118.43 144.69 45.78 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.486 -178.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.447 ' HA2' ' O ' ' A' ' 70' ' ' GLN . . . -136.29 150.28 20.4 Favored Glycine 0 N--CA 1.435 -1.379 0 C-N-CA 120.195 -1.002 . . . . 0.0 111.938 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 25.8 m -127.36 134.29 49.97 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-O 120.981 0.419 . . . . 0.0 111.903 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.696 HD23 ' CE1' ' A' ' 69' ' ' TYR . 2.8 tm? -74.4 127.49 33.16 Favored 'General case' 0 N--CA 1.427 -1.62 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.235 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -86.77 -50.75 6.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.567 -177.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -144.08 142.02 30.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.83 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.526 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -135.18 140.02 45.02 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.7 mp -89.12 175.92 7.18 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 120.915 0.388 . . . . 0.0 110.582 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -83.23 0.52 45.16 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.909 0.385 . . . . 0.0 111.578 -176.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -101.19 15.14 29.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.162 0.506 . . . . 0.0 110.339 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -173.9 123.64 0.34 Allowed 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.04 -176.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -93.58 110.14 21.75 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.331 0.586 . . . . 0.0 109.654 177.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 75.7 m -109.91 133.05 53.59 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.114 -177.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -66.96 150.81 48.71 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.01 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -74.82 -29.63 61.13 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.939 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 9.7 t -146.05 150.06 35.27 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.766 0.793 . . . . 0.0 112.263 178.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 28.7 m -135.49 146.87 29.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.316 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 95.8 m -128.43 127.68 43.0 Favored 'General case' 0 C--N 1.293 -1.889 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 176.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 13.5 tt -136.02 148.62 27.65 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 CA-C-O 120.818 0.342 . . . . 0.0 110.611 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 84' ' ' LYS . 54.6 m -130.3 135.68 48.34 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.097 -179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -133.26 148.59 69.68 Favored Pre-proline 0 C--N 1.319 -0.745 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.876 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.488 ' HA ' ' CD2' ' A' ' 83' ' ' LEU . 34.4 Cg_exo -59.63 131.98 43.16 Favored 'Trans proline' 0 CA--C 1.516 -0.408 0 C-N-CA 122.63 2.22 . . . . 0.0 113.022 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.623 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 78.8 m -75.31 -17.02 60.37 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.349 0.595 . . . . 0.0 109.938 176.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -124.48 -139.11 5.24 Favored Glycine 0 N--CA 1.439 -1.105 0 N-CA-C 110.084 -1.207 . . . . 0.0 110.084 177.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.483 ' HG2' ' H ' ' A' ' 112' ' ' LEU . 75.1 tttt 66.58 175.84 0.24 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 122.415 0.286 . . . . 0.0 110.723 177.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.483 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 9.9 mp 71.25 167.46 0.31 Allowed 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.528 0.731 . . . . 0.0 111.501 178.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.1 p -78.41 116.24 18.69 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.842 179.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.548 ' HB3' ' HD3' ' A' ' 115' ' ' PRO . 40.0 ttmt -135.16 -48.59 0.02 OUTLIER Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.618 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.548 ' HD3' ' HB3' ' A' ' 114' ' ' LYS . 31.4 Cg_exo -68.56 -139.17 0.01 OUTLIER 'Trans proline' 0 C--N 1.375 1.968 0 C-N-CA 121.992 1.795 . . . . 0.0 112.245 175.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 65.6 tttp 62.55 63.13 1.91 Allowed Pre-proline 0 N--CA 1.446 -0.655 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.065 -177.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -42.16 117.96 0.89 Allowed 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 123.521 2.814 . . . . 0.0 111.839 176.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -88.0 93.0 9.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.244 0.545 . . . . 0.0 111.7 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -94.45 78.22 3.86 Favored 'General case' 0 N--CA 1.434 -1.255 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.765 177.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -90.69 26.16 2.12 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.029 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 7.2 m -70.65 -23.71 62.57 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.612 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.1 mmtm 70.7 -68.01 0.23 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.882 0.873 . . . . 0.0 111.261 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -140.09 153.81 46.85 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.009 178.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -89.04 -35.78 16.16 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 176.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -122.71 98.96 6.15 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.254 176.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -65.19 -48.47 73.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.095 0.474 . . . . 0.0 110.841 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -150.49 -169.45 3.39 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.432 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 138.33 70.47 0.05 OUTLIER Glycine 0 N--CA 1.441 -1.009 0 C-N-CA 120.19 -1.005 . . . . 0.0 112.154 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -101.96 142.0 33.92 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 178.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -82.69 60.2 5.14 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.25 -179.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 63.52 -178.13 0.15 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.443 0.64 . . . . 0.0 111.477 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -108.72 161.7 14.85 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.367 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -88.67 157.11 18.65 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.967 0.413 . . . . 0.0 111.23 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 95.9 mmm -87.28 133.53 33.67 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.682 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -84.46 158.7 20.95 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.918 -177.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 C--O 1.248 1.007 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.298 -179.545 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.305 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -159.7 179.33 8.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.609 0.243 . . . . 0.0 110.356 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -89.03 86.0 6.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.996 0.427 . . . . 0.0 110.092 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -99.85 159.68 14.89 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.113 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -66.18 128.36 93.79 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.881 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -61.48 -153.65 0.02 OUTLIER 'Trans proline' 0 CA--C 1.504 -0.983 0 C-N-CA 123.643 2.895 . . . . 0.0 114.22 175.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -106.16 55.65 0.67 Allowed 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 112.941 -1.936 . . . . 0.0 111.172 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp 50.46 86.4 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.616 -179.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -115.25 172.12 7.27 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 120.883 0.373 . . . . 0.0 111.402 -178.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.2 p -152.48 157.48 4.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.134 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.3 mttp -98.45 160.65 14.14 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.009 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -60.1 109.82 1.06 Allowed 'General case' 0 N--CA 1.439 -1.011 0 CA-C-O 121.09 0.471 . . . . 0.0 111.256 -179.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.8 m -109.4 119.59 39.93 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.415 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -107.26 151.42 25.47 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.936 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 75.9 m 55.35 81.62 0.11 Allowed 'General case' 0 C--O 1.234 0.264 0 O-C-N 123.725 0.641 . . . . 0.0 110.207 -178.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -144.19 -178.98 20.34 Favored Glycine 0 N--CA 1.441 -0.997 0 C-N-CA 120.303 -0.951 . . . . 0.0 114.115 -174.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -73.97 167.95 20.48 Favored 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 123.915 0.886 . . . . 0.0 111.816 -179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -49.4 125.14 10.52 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 114.648 -1.16 . . . . 0.0 112.159 178.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -115.5 123.06 47.57 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 176.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -102.83 133.11 48.45 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.167 0.508 . . . . 0.0 111.781 -175.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.9 p -96.11 170.09 9.51 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.654 178.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 27.3 m -87.23 131.01 36.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 122.494 1.14 . . . . 0.0 111.555 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 35' ' ' ARG . 50.9 t -81.15 135.85 35.83 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 112.947 -1.933 . . . . 0.0 112.779 -175.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.496 ' O ' ' HA3' ' A' ' 33' ' ' GLY . 57.5 t -100.44 100.65 12.59 Favored Pre-proline 0 N--CA 1.438 -1.054 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 171.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.564 ' O ' ' HB ' ' A' ' 26' ' ' THR . 72.3 Cg_endo -74.89 0.92 8.25 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.782 2.321 . . . . 0.0 113.361 -174.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.564 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 17.0 m 80.9 -39.09 0.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 122.794 0.438 . . . . 0.0 110.611 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.1 t 75.21 179.56 0.19 Allowed 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.616 176.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.21 8.05 48.15 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.023 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 64.09 10.01 5.1 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.428 0.691 . . . . 0.0 111.577 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 59.2 m -159.14 30.55 0.21 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -176.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -109.14 140.11 15.52 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 119.898 -1.144 . . . . 0.0 113.443 -174.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.463 HD12 ' O ' ' A' ' 53' ' ' CYS . 47.6 tp -100.52 127.04 47.0 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 176.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.496 ' HA3' ' O ' ' A' ' 24' ' ' VAL . . . -126.7 -173.49 13.55 Favored Glycine 0 C--N 1.316 -0.544 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.416 HG22 ' HG2' ' A' ' 52' ' ' ARG . 1.3 p -137.02 153.32 50.67 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 118.893 1.346 . . . . 0.0 112.986 -178.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.479 ' HB2' ' HB2' ' A' ' 23' ' ' CYS . 45.3 ttm180 -131.57 137.91 48.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.614 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.438 ' HG2' HG22 ' A' ' 50' ' ' THR . 42.9 mt-10 -115.35 130.41 56.89 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 120.679 0.276 . . . . 0.0 111.029 -178.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -127.88 135.71 8.82 Favored Glycine 0 N--CA 1.435 -1.405 0 N-CA-C 109.038 -1.625 . . . . 0.0 109.038 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 29.8 m -129.06 148.48 51.01 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 117.964 0.882 . . . . 0.0 110.361 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -142.63 162.03 36.53 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.78 145.21 33.03 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 175.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -101.65 -158.52 26.73 Favored Glycine 0 N--CA 1.437 -1.235 0 C-N-CA 120.069 -1.062 . . . . 0.0 112.155 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.18 -31.54 72.01 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.15 0.5 . . . . 0.0 110.325 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.5 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 27.9 mm-40 -89.49 2.45 54.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.831 178.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 35.89 59.37 0.88 Allowed 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -174.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 74.5 mmtt -128.62 143.43 50.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.884 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.513 ' HG3' ' H ' ' A' ' 47' ' ' THR . 18.7 pt20 36.02 -108.7 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.575 1.15 . . . . 0.0 113.886 -178.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.513 ' H ' ' HG3' ' A' ' 46' ' ' GLN . 3.0 p 46.35 45.59 13.4 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.891 0.876 . . . . 0.0 113.189 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -125.48 138.34 53.99 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.808 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -136.18 143.75 44.6 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 121.011 0.434 . . . . 0.0 110.385 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.438 HG22 ' HG2' ' A' ' 36' ' ' GLU . 16.6 p -117.65 137.46 52.63 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 66.5 mm-40 -122.24 151.81 40.67 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -177.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HG2' HG22 ' A' ' 34' ' ' THR . 83.8 mtm180 -107.92 126.98 53.33 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 176.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.463 ' O ' HD12 ' A' ' 32' ' ' LEU . 36.3 m -88.32 125.23 34.58 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -111.85 138.87 47.87 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 121.124 0.488 . . . . 0.0 112.041 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.1 mm -114.19 106.05 53.43 Favored Pre-proline 0 N--CA 1.436 -1.148 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.42 ' HB2' ' HD3' ' A' ' 60' ' ' LYS . 22.3 Cg_exo -64.67 100.44 0.34 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.187 1.924 . . . . 0.0 111.358 179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.8 t -72.64 -34.05 67.04 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.897 -178.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -71.44 145.22 49.4 Favored 'General case' 0 C--O 1.246 0.877 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.677 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 1.6 p90 -55.36 116.97 3.14 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.293 0.568 . . . . 0.0 110.094 176.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.42 ' HD3' ' HB2' ' A' ' 56' ' ' PRO . 15.3 mtmm -78.5 -80.89 0.11 Allowed 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.368 -175.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 31.9 ttmt 55.48 25.62 8.02 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.454 0.645 . . . . 0.0 111.211 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -132.28 30.82 4.16 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.505 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -66.79 97.81 0.49 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.43 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.578 ' HA3' ' CG ' ' A' ' 69' ' ' TYR . . . 66.67 18.5 68.21 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.643 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.71 -13.51 48.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.097 0.475 . . . . 0.0 110.743 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -88.96 -5.26 58.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.397 0.618 . . . . 0.0 109.706 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 10.1 p -147.44 -118.08 0.07 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.703 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 92' ' ' ARG . 62.9 mttp -133.38 125.9 30.13 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 122.204 -0.31 . . . . 0.0 110.453 178.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.578 ' CG ' ' HA3' ' A' ' 64' ' ' GLY . 0.3 OUTLIER -130.94 152.9 49.76 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.174 0.511 . . . . 0.0 111.877 -175.997 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -103.27 118.43 36.76 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.22 178.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -97.6 114.62 26.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -175.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.422 ' HG2' ' HB ' ' A' ' 87' ' ' THR . 6.6 tt0 -123.63 136.83 54.72 Favored 'General case' 0 N--CA 1.422 -1.84 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.636 175.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 57.08 36.32 27.5 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.545 0.688 . . . . 0.0 111.179 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 90.5 t90 -86.62 -23.9 25.54 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.718 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.03 -88.36 0.08 OUTLIER Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 116.054 1.181 . . . . 0.0 116.054 -175.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -117.47 143.88 45.59 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -169.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 8.4 t -69.8 159.32 33.81 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.759 175.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -94.32 115.91 28.2 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-O 121.354 0.597 . . . . 0.0 111.108 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.501 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.6 pt? -71.16 -30.61 66.66 Favored 'General case' 0 C--N 1.298 -1.631 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.958 -178.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -66.9 -33.26 75.2 Favored 'General case' 0 CA--C 1.496 -1.113 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.165 -177.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.502 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 67.8 p -107.72 -8.33 16.11 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.045 -177.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.426 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 59.1 38.3 23.91 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.419 -175.136 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 81' ' ' THR . 81.0 mt -130.02 148.84 51.92 Favored 'General case' 0 CA--C 1.49 -1.336 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.488 -175.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.767 ' HB2' ' SG ' ' A' ' 109' ' ' CYS . 60.6 tttp -127.05 135.53 50.92 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.649 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 15.0 t -139.37 145.78 39.41 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.71 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -136.44 130.06 32.08 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.896 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.422 ' HB ' ' HG2' ' A' ' 72' ' ' GLN . 4.0 m -120.87 143.69 48.78 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.309 -179.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -149.84 152.34 24.28 Favored Glycine 0 N--CA 1.436 -1.356 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.899 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.8 m -146.12 144.19 29.83 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.379 -0.411 . . . . 0.0 111.58 177.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.677 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 4.9 tt -72.26 122.45 21.12 Favored 'General case' 0 N--CA 1.432 -1.365 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 176.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.469 ' HE2' ' O ' ' A' ' 69' ' ' TYR . 46.1 pttt -104.93 -12.58 16.15 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -178.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.575 ' HB2' ' HB2' ' A' ' 68' ' ' LYS . 21.2 mmt180 -150.94 134.19 16.12 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -111.17 132.64 54.15 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.411 -178.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.457 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 10.3 mp -94.47 152.61 18.44 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.004 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -76.82 -10.37 59.33 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.95 0.405 . . . . 0.0 111.288 -178.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -125.07 19.93 8.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.281 0.563 . . . . 0.0 111.05 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.457 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -156.23 112.25 3.03 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.701 -178.068 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -91.32 110.97 22.27 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 177.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . 0.466 ' HB2' ' CD1' ' A' ' 90' ' ' LEU . 91.2 m -101.53 162.64 12.75 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.65 0.738 . . . . 0.0 112.863 -177.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.677 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 3.1 pt20 -66.77 130.49 43.35 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.075 -1.421 . . . . 0.0 108.91 176.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.44 ' HA ' ' HB3' ' A' ' 90' ' ' LEU . 29.0 tptp -76.72 -44.97 31.24 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.173 -174.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.9 t -151.34 153.05 34.03 Favored 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 119.862 -0.735 . . . . 0.0 111.689 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 m -143.71 136.7 24.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.953 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 89.2 m -130.83 124.25 30.87 Favored 'General case' 0 C--N 1.291 -1.961 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.423 175.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 11.3 tt -140.6 136.56 35.72 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.208 0 CA-C-O 121.453 0.644 . . . . 0.0 111.323 -179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.8 m -126.56 131.37 51.56 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.44 178.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -133.59 106.99 11.89 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.815 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.12 125.01 16.99 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.33 2.02 . . . . 0.0 111.829 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.767 ' SG ' ' HB2' ' A' ' 84' ' ' LYS . 86.8 m -85.52 -178.04 6.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.549 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -107.12 174.06 19.5 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 111.127 -0.789 . . . . 0.0 111.127 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -107.88 168.49 9.24 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.86 0.33 . . . . 0.0 110.713 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 59.1 tp -83.12 138.76 33.54 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.387 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.1 p -76.71 126.63 31.3 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.296 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 59.1 mttp 61.08 73.53 0.59 Allowed Pre-proline 0 N--CA 1.467 0.384 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.773 -178.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . 0.412 ' O ' ' HG2' ' A' ' 116' ' ' LYS . 91.0 Cg_exo -51.62 -61.29 0.55 Allowed 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 123.287 2.658 . . . . 0.0 112.562 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 115' ' ' PRO . 15.5 pttm 41.38 54.7 8.05 Favored Pre-proline 0 CA--C 1.553 1.081 0 C-N-CA 123.999 0.92 . . . . 0.0 113.236 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.49 135.66 70.26 Favored 'Trans proline' 0 C--N 1.366 1.475 0 C-N-CA 122.398 2.065 . . . . 0.0 111.869 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -71.08 -48.18 53.95 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.13 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -165.06 139.09 4.88 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.643 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -140.55 135.7 32.1 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.095 0.474 . . . . 0.0 111.028 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 33.0 t -128.2 106.24 8.9 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.178 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 18.6 pttp -127.36 86.26 2.47 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.376 0.608 . . . . 0.0 110.414 178.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -115.0 136.08 53.52 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.312 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -165.59 155.76 13.04 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.843 0.354 . . . . 0.0 110.919 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -130.81 89.12 2.71 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.591 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 68.2 mttm 59.24 -168.14 0.15 Allowed 'General case' 0 C--O 1.24 0.563 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.45 -178.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -159.08 174.54 14.75 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.525 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 125.48 -122.48 4.6 Favored Glycine 0 N--CA 1.435 -1.37 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.281 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -117.57 147.11 43.12 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.893 0.377 . . . . 0.0 111.044 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -157.33 142.42 16.99 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.38 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 73.21 -43.35 0.56 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.353 0.661 . . . . 0.0 111.316 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -72.41 129.85 39.32 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? 69.52 147.52 0.06 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.572 0.749 . . . . 0.0 110.84 -177.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 88.3 mtp 64.91 19.32 11.82 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.39 0.614 . . . . 0.0 110.709 -177.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 56.1 tp -89.4 127.54 35.83 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.363 -0.835 . . . . 0.0 109.786 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 . . . . . 0 C--N 1.307 -1.276 0 CA-C-O 118.472 -0.775 . . . . 0.0 110.629 -179.125 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.308 -0.317 . . . . 0.0 112.308 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt 55.34 73.29 0.43 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.476 0.655 . . . . 0.0 110.472 -178.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.55 -171.86 2.08 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.672 -177.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 72.86 -58.22 0.61 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.866 0.866 . . . . 0.0 111.92 178.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.9 mttm 64.82 94.52 0.05 OUTLIER Pre-proline 0 N--CA 1.47 0.529 0 O-C-N 123.671 0.607 . . . . 0.0 111.625 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.427 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 10.9 Cg_endo -83.33 -133.33 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.91 2.406 . . . . 0.0 110.882 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.427 ' H ' ' HB2' ' A' ' 6' ' ' PRO . 24.1 mt-10 -88.68 87.14 7.15 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.461 -178.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -176.17 116.35 0.13 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.139 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -93.35 144.21 25.54 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-O 120.771 0.32 . . . . 0.0 111.135 178.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.6 p -154.17 140.19 11.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-O 121.39 0.614 . . . . 0.0 110.548 178.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.2 pttt -103.24 127.32 50.59 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.224 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.466 ' HB2' ' OE1' ' A' ' 19' ' ' GLN . 60.7 mttp -61.2 -63.84 1.15 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.159 0.504 . . . . 0.0 110.115 179.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.1 m -153.31 108.46 3.2 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.72 177.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -77.79 136.12 38.07 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.737 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 39.4 m 62.05 70.6 0.57 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 122.033 0.92 . . . . 0.0 110.261 -178.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -156.67 178.87 32.89 Favored Glycine 0 N--CA 1.45 -0.407 0 CA-C-N 114.266 -1.334 . . . . 0.0 113.192 -176.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 19' ' ' GLN . 42.0 mm-40 -74.86 169.17 18.46 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 123.028 0.531 . . . . 0.0 111.737 -178.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.594 ' CD2' ' HB2' ' A' ' 39' ' ' ARG . 94.7 m95 -48.27 119.48 3.0 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.066 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 17' ' ' GLU . 28.2 mt-30 -108.83 115.73 30.64 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 177.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -105.26 145.12 31.1 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-O 121.686 0.755 . . . . 0.0 112.95 -174.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -93.64 175.23 6.82 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.517 -1.22 . . . . 0.0 108.89 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.3 m -94.2 129.18 44.84 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -176.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.75 96.05 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.396 -179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -102.03 101.04 16.73 Favored Pre-proline 0 N--CA 1.439 -1.01 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.652 ' O ' ' HB ' ' A' ' 26' ' ' THR . 56.9 Cg_endo -71.98 -20.78 25.12 Favored 'Trans proline' 0 C--O 1.207 -1.07 0 C-N-CA 122.277 1.984 . . . . 0.0 111.068 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.652 ' HB ' ' O ' ' A' ' 25' ' ' PRO . 7.8 m 107.41 -32.47 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.948 1.299 . . . . 0.0 110.155 177.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.9 t 75.51 -162.32 0.06 Allowed 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.482 175.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.97 -93.62 1.05 Allowed Glycine 0 CA--C 1.49 -1.53 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 -175.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.459 ' O ' ' HB2' ' A' ' 30' ' ' CYS . 9.8 p-10 -160.13 58.93 0.35 Allowed 'General case' 0 C--N 1.284 -2.271 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 177.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 29' ' ' ASP . 83.3 m 83.14 97.41 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 112.717 -2.038 . . . . 0.0 110.135 -176.071 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -127.3 156.45 20.39 Favored Glycine 0 N--CA 1.434 -1.484 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.826 -178.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.5 tp -80.95 131.39 35.33 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.947 0.374 . . . . 0.0 110.29 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 25' ' ' PRO . . . -139.82 173.93 22.63 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 -176.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 p -143.55 160.14 41.16 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -174.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 35' ' ' ARG . 42.2 ttp180 -137.41 137.15 38.5 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.927 176.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.12 132.44 56.6 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.722 -0.217 . . . . 0.0 111.145 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 19' ' ' GLN . . . -133.02 128.29 5.05 Favored Glycine 0 N--CA 1.445 -0.752 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 176.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.418 HG22 ' HB2' ' A' ' 48' ' ' MET . 66.5 p -130.99 146.9 52.53 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 117.532 0.666 . . . . 0.0 110.65 -176.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.594 ' HB2' ' CD2' ' A' ' 18' ' ' TRP . 6.7 ttp85 -143.83 155.51 44.15 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.568 HG22 ' H ' ' A' ' 46' ' ' GLN . 0.7 OUTLIER -149.44 144.0 26.06 Favored 'General case' 0 C--N 1.303 -1.42 0 CA-C-O 120.781 0.324 . . . . 0.0 110.172 176.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -85.89 -173.48 49.41 Favored Glycine 0 CA--C 1.499 -0.925 0 N-CA-C 110.275 -1.13 . . . . 0.0 110.275 176.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.61 -30.91 69.02 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.342 0.591 . . . . 0.0 109.998 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -89.17 6.33 40.58 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.76 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 10.1 m 46.95 79.63 0.06 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.575 0.702 . . . . 0.0 112.589 -175.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.7 tptt -82.75 2.83 31.95 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.901 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.568 ' H ' HG22 ' A' ' 40' ' ' THR . 93.4 mt-30 48.67 56.27 7.85 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.915 -178.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 m -89.72 102.75 15.44 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.135 0.493 . . . . 0.0 109.937 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.418 ' HB2' HG22 ' A' ' 38' ' ' THR . 20.5 ptp -136.7 146.29 45.7 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-O 121.078 0.466 . . . . 0.0 111.902 -176.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.437 ' HA ' ' HE3' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -143.04 143.27 31.82 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.484 179.535 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 18.7 m -115.82 138.16 51.41 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.143 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -133.4 146.44 51.22 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.183 0.516 . . . . 0.0 111.518 -175.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -85.0 137.36 33.12 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 176.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.0 t -91.21 154.51 19.25 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 -177.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -112.85 138.87 49.04 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.219 0.533 . . . . 0.0 111.2 -176.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 4.9 tp -118.38 112.79 37.29 Favored Pre-proline 0 C--N 1.319 -0.729 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.888 -178.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.39 106.54 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.668 2.245 . . . . 0.0 112.079 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 79.7 m -95.9 178.23 5.5 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.146 -179.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -70.62 147.33 49.31 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.67 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 63.9 p-90 -62.34 165.75 5.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.069 -179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -131.52 177.6 7.37 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.604 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -92.51 -2.6 56.11 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.441 0.639 . . . . 0.0 109.437 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -137.02 100.43 4.28 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.482 ' HB3' ' NE2' ' A' ' 100' ' ' GLN . 98.8 m-85 -82.08 47.28 1.1 Allowed 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.17 -174.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.65 179.27 24.43 Favored Glycine 0 N--CA 1.442 -0.911 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.017 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -112.56 -62.95 1.5 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.937 0.398 . . . . 0.0 110.426 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -101.11 -5.51 25.58 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.535 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.457 ' SG ' HD21 ' A' ' 90' ' ' LEU . 11.8 t -76.78 167.82 21.16 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 176.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.415 ' O ' HD22 ' A' ' 90' ' ' LEU . 56.3 mttp -125.08 125.58 44.01 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.018 -177.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.417 ' HE1' ' HB2' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -124.56 153.56 41.95 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.802 -178.424 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -100.81 140.22 35.4 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.217 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -96.31 139.76 31.98 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.743 0.817 . . . . 0.0 109.008 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.404 HE21 ' HB3' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -77.97 164.76 24.81 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -144.75 28.97 1.25 Allowed 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -176.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 48.8 t-105 -87.31 -14.03 41.98 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.794 -175.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 108.11 127.07 5.56 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 119.884 -1.151 . . . . 0.0 111.075 -175.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -105.46 134.11 49.12 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-O 120.763 0.315 . . . . 0.0 111.547 -178.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 52.7 t 68.12 104.29 0.05 Allowed 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.809 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.485 ' HB2' ' OG1' ' A' ' 81' ' ' THR . 20.6 m-20 -87.49 112.06 21.81 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 177.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 30.9 mt -69.38 -30.22 68.16 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.795 -175.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -67.83 -29.93 69.21 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.254 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.57 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 71.5 p -104.45 -8.23 19.27 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.566 -0.453 . . . . 0.0 111.163 -177.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.454 ' O ' HD23 ' A' ' 83' ' ' LEU . . . 59.67 30.39 20.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.512 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 81' ' ' THR . 67.3 mt -129.06 160.37 33.0 Favored 'General case' 0 CA--C 1.498 -1.032 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.204 -175.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 109' ' ' CYS . 35.6 tttp -129.06 140.33 51.65 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.218 -178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.4 t -137.81 145.32 42.18 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.535 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 13.5 mtt180 -140.34 128.99 22.95 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.14 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.2 t -123.82 146.78 48.12 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.928 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -150.08 152.33 24.26 Favored Glycine 0 N--CA 1.437 -1.278 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.16 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 48.9 m -138.85 148.72 44.06 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.113 0.482 . . . . 0.0 111.976 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.7 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 3.3 tm? -79.49 126.14 30.47 Favored 'General case' 0 N--CA 1.423 -1.811 0 C-N-CA 123.939 0.895 . . . . 0.0 109.121 178.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -87.53 -33.77 18.84 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.326 -0.55 . . . . 0.0 112.325 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -160.71 141.03 11.36 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -105.22 152.51 22.77 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.935 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.689 ' HB2' ' HB3' ' A' ' 97' ' ' ALA . 3.2 mm? -91.02 176.21 6.68 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.889 0.376 . . . . 0.0 110.752 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -73.95 -27.85 61.21 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.888 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -130.45 43.69 3.08 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.697 0.761 . . . . 0.0 109.971 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.689 ' HB3' ' HB2' ' A' ' 94' ' ' LEU . . . -152.11 97.93 2.37 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.08 -0.964 . . . . 0.0 111.142 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -80.32 110.57 15.88 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 71.4 m -110.76 152.8 26.18 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.122 0.487 . . . . 0.0 111.607 -177.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.7 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 4.8 pm0 -68.46 132.71 47.47 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.677 177.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -74.25 -43.2 57.93 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 122.692 0.397 . . . . 0.0 111.333 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.3 t -155.52 146.41 22.35 Favored 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 119.216 -0.994 . . . . 0.0 112.101 175.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 35.0 m -133.13 138.56 51.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.545 176.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 58.3 m -129.83 127.85 41.11 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 114.726 -1.125 . . . . 0.0 108.993 177.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 19.8 pt -136.69 136.63 48.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-O 120.919 0.39 . . . . 0.0 111.163 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.6 t -126.85 135.36 50.88 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.909 178.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -135.53 130.98 19.16 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.415 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -52.33 126.53 20.85 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 121.27 1.313 . . . . 0.0 109.946 174.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 84' ' ' LYS . 33.7 t -101.33 -46.18 5.1 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -172.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -62.44 -41.57 99.76 Favored Glycine 0 CA--C 1.509 -0.337 0 C-N-CA 121.085 -0.578 . . . . 0.0 113.095 -175.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 8.0 ttpm? -120.31 135.64 54.95 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-O 120.704 0.287 . . . . 0.0 110.318 -178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 89.2 mt -76.88 109.76 10.95 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.684 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 7.7 p -91.76 114.1 26.55 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.638 177.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.91 82.85 60.5 Favored Pre-proline 0 C--N 1.312 -1.054 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.965 -179.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -65.29 165.12 23.19 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.373 2.716 . . . . 0.0 113.124 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -137.43 64.12 44.27 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.726 173.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.01 101.64 0.16 Allowed 'Trans proline' 0 C--N 1.355 0.908 0 C-N-CA 122.402 2.068 . . . . 0.0 112.13 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -76.11 -46.37 29.24 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 56.41 -171.7 0.08 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-N 114.649 -1.159 . . . . 0.0 112.575 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -122.58 167.56 13.25 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.825 177.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 13.5 t -76.88 93.06 3.7 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-O 121.263 0.554 . . . . 0.0 109.671 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -92.08 104.69 17.05 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.02 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.419 ' HE2' ' O ' ' A' ' 125' ' ' LYS . 26.0 pttm -113.49 156.78 22.94 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.597 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 124' ' ' LYS . 38.5 ttmt -85.48 -33.31 21.88 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.192 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.419 ' O ' ' HE2' ' A' ' 123' ' ' LYS . 87.2 tttt -62.65 136.47 57.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.936 178.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 65.8 pttt -86.16 -177.13 6.19 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 120.866 0.365 . . . . 0.0 110.811 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -85.03 86.24 7.4 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -147.0 101.92 0.24 Allowed Glycine 0 N--CA 1.437 -1.271 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.205 -178.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -145.75 145.66 30.92 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 178.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 98.5 mttt 62.91 -169.77 0.18 Allowed 'General case' 0 C--O 1.24 0.562 0 O-C-N 123.62 0.575 . . . . 0.0 109.949 -175.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 56.73 68.79 0.81 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.192 0.52 . . . . 0.0 111.414 178.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -112.04 129.48 56.19 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.161 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.0 mttt 61.12 82.83 0.16 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.412 0.625 . . . . 0.0 111.287 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 84.5 mtp -83.06 131.02 35.18 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.856 -178.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 92.1 mt 62.24 25.85 15.47 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.17 0.588 . . . . 0.0 111.142 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 C--O 1.245 0.862 0 CA-C-O 118.495 -0.764 . . . . 0.0 110.628 179.689 . . . . . . . . 0 0 . 1 stop_ save_