data_2b86_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 2b86 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.414 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 79.9 t . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 120.79 0.329 . . . . 0.0 110.377 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 30.3 mm -98.49 114.58 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.16 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 22.4 m -132.25 165.66 31.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.969 0.414 . . . . 0.0 111.259 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.4 mt -128.84 129.02 68.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.51 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.93 141.14 45.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.605 -178.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -105.11 -20.18 13.6 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.746 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.546 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 18.4 m-90 -140.98 150.67 43.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.973 0.416 . . . . 0.0 110.027 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.8 p-10 -69.56 129.72 40.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.216 0.531 . . . . 0.0 112.072 -178.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -127.9 140.58 51.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.772 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.9 t -105.85 138.47 41.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.599 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.91 138.32 57.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.38 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -86.09 -3.26 58.91 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.364 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -146.17 170.15 17.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.708 0.29 . . . . 0.0 110.283 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -74.02 -27.29 60.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.497 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -80.56 -9.71 59.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.505 ' HB3' HG13 ' A' ' 51' ' ' VAL . 0.5 OUTLIER -93.26 171.98 8.58 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.758 -179.889 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.466 ' O ' HG12 ' A' ' 51' ' ' VAL . 8.0 mp -120.19 134.88 55.15 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -74.62 147.0 42.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.424 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 46.0 pt -127.73 169.4 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.022 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -117.34 -176.74 3.07 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.158 0.504 . . . . 0.0 111.85 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -65.85 -37.55 86.5 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.786 -178.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -126.78 39.06 4.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.873 0.368 . . . . 0.0 111.409 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -100.37 132.41 45.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.9 mtm105 -88.08 125.7 34.71 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.451 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.467 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 1.1 mm? -116.07 150.31 37.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.824 -178.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 31.1 m-90 -102.62 105.82 16.38 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.442 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.437 ' HA ' HG21 ' A' ' 41' ' ' VAL . 88.4 mt -79.62 142.55 35.51 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.927 0.394 . . . . 0.0 112.028 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 41' ' ' VAL . 3.9 mp -111.3 -29.11 7.95 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.186 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -158.57 117.6 3.07 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.861 0.363 . . . . 0.0 111.251 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.422 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.4 p-10 -110.56 4.84 20.68 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.2 m -67.79 -36.22 80.05 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.815 0.341 . . . . 0.0 111.326 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -83.54 158.61 21.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.667 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 89.6 m -56.35 -35.22 67.38 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.332 178.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.9 m0 -99.15 133.05 43.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.422 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 42.2 m0 -104.39 134.68 47.19 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.42 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 53.4 ttt180 -86.62 133.08 33.73 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 178.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.473 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -137.78 161.49 33.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.02 0.438 . . . . 0.0 111.91 -177.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -124.24 149.7 46.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.621 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -121.81 160.72 24.05 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.08 0.466 . . . . 0.0 111.488 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.97 -19.83 13.98 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.6 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.99 5.35 11.91 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 72.56 22.74 3.23 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 122.527 0.331 . . . . 0.0 111.452 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -108.19 146.43 32.78 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 75.6 p -134.95 147.78 49.86 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.846 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.26 174.72 43.7 Favored Glycine 0 C--N 1.339 0.733 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.29 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.42 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 89.4 m-85 -102.59 108.31 19.54 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.505 HG13 ' HB3' ' A' ' 20' ' ' GLU . 22.3 m -127.32 115.87 21.52 Favored Pre-proline 0 CA--C 1.533 0.314 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.1 63.65 4.19 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 121.564 1.51 . . . . 0.0 110.968 178.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.98 76.72 1.18 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.516 -178.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -60.45 -19.17 55.52 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.208 177.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.546 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 71.5 m-85 -86.91 44.21 1.15 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.004 -0.544 . . . . 0.0 112.122 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.9 p -136.36 146.77 28.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.838 0.352 . . . . 0.0 111.001 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -122.82 140.12 53.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.312 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -75.25 139.97 42.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.854 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.855 179.697 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.7 t . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.96 0.409 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.1 mt -107.32 115.52 48.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.197 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 21.5 m -128.83 161.09 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 111.411 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 16.2 mt -119.83 128.72 75.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.12 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -84.71 117.46 23.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.004 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -90.92 -3.71 57.1 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.489 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 15.9 m-90 -147.08 141.65 26.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.785 0.326 . . . . 0.0 110.377 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.2 p-10 -71.31 120.0 16.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.847 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -127.62 137.11 52.45 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.57 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.6 m -99.93 141.97 32.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.748 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.451 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.48 131.98 51.77 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.792 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -63.72 -30.94 71.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.118 0.485 . . . . 0.0 110.184 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -137.69 160.89 37.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.256 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -59.54 -35.07 73.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.935 0.398 . . . . 0.0 111.169 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -65.19 -20.11 66.29 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.282 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.451 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 3.0 mm-40 -83.79 -179.35 7.27 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.59 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.46 HD21 ' HB2' ' A' ' 43' ' ' ASN . 24.1 tp -120.57 140.53 51.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.028 0.442 . . . . 0.0 112.085 -178.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -84.2 146.45 27.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.65 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 45.3 pt -131.36 160.99 41.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.192 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -116.71 167.24 11.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.073 0.464 . . . . 0.0 111.386 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.426 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 52.1 pttt -67.21 -14.86 63.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.79 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -140.0 22.21 2.44 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.671 -0.411 . . . . 0.0 111.561 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -99.67 135.42 41.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.899 0.38 . . . . 0.0 110.516 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 69.2 mtp180 -90.53 120.77 31.9 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.754 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.446 ' N ' ' CD2' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -115.69 148.0 40.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.577 -179.601 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -101.62 109.77 21.63 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.079 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.434 HD23 ' CE3' ' A' ' 39' ' ' TRP . 0.2 OUTLIER -81.02 152.63 27.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.383 0.611 . . . . 0.0 112.255 -179.05 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -110.93 -25.4 9.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.07 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -160.99 117.41 2.26 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.745 0.307 . . . . 0.0 111.067 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.5 p-10 -110.8 7.18 21.89 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 86.0 p -74.1 -36.57 64.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.82 0.343 . . . . 0.0 111.371 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -81.1 161.41 24.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.371 0.605 . . . . 0.0 112.31 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 17.6 p -57.55 -40.5 79.02 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.007 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.449 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 43.8 m95 -93.94 131.17 39.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.918 177.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.434 ' CE3' HD23 ' A' ' 31' ' ' LEU . 32.0 m0 -102.67 129.68 49.34 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.433 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 44.3 ttt180 -91.78 127.17 37.13 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.441 ' CG2' ' HB3' ' A' ' 29' ' ' LEU . 3.2 p -140.16 161.97 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -177.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.9 ttt85 -126.23 145.51 50.37 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.723 0.297 . . . . 0.0 111.202 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.46 ' HB2' HD21 ' A' ' 21' ' ' LEU . 61.8 t30 -113.19 161.54 17.04 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.917 0.389 . . . . 0.0 111.824 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.98 -21.05 58.01 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.262 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.65 6.35 15.45 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 68.05 26.07 7.37 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.949 0.404 . . . . 0.0 111.26 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -110.23 123.44 49.78 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 52.5 p -121.74 156.94 32.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.749 0.309 . . . . 0.0 111.208 -179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.436 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -173.48 171.03 44.18 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.365 -0.922 . . . . 0.0 113.308 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 90.4 m-85 -103.54 112.53 25.49 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.747 0.308 . . . . 0.0 111.28 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.9 m -132.29 114.74 14.85 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.03 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.449 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 8.7 Cg_exo -73.63 36.99 0.4 Allowed 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.721 2.281 . . . . 0.0 113.026 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.69 92.98 0.35 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 120.865 0.364 . . . . 0.0 111.267 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -62.17 -17.55 58.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.281 178.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.489 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.0 m-85 -59.93 -14.82 17.48 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 8.1 p -112.72 140.44 32.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.083 0.468 . . . . 0.0 110.835 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -136.82 165.24 26.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.064 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -69.55 139.43 53.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.915 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.7 pttp . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.738 179.977 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.448 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.1 t . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.577 0.227 . . . . 0.0 110.627 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.8 mt -111.67 118.32 57.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.673 0.273 . . . . 0.0 111.709 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.425 ' CG1' ' HG2' ' A' ' 58' ' ' ARG . 21.4 m -134.11 160.67 41.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.034 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.44 ' HA ' ' HA ' ' A' ' 28' ' ' ARG . 33.6 mt -121.07 124.05 71.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.312 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.76 125.2 28.61 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.932 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.1 mttm -90.99 -9.24 46.72 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.543 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 12.5 m-90 -146.64 145.98 30.24 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.867 0.365 . . . . 0.0 110.876 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -69.91 125.23 26.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.995 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.431 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 65.6 t80 -127.81 141.16 51.65 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.502 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -104.19 136.66 43.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.922 0.392 . . . . 0.0 110.897 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.421 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.26 133.04 54.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.384 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -65.77 -34.27 77.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.187 0.518 . . . . 0.0 110.182 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -131.83 163.94 27.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.329 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -63.52 -31.15 72.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.864 0.364 . . . . 0.0 111.335 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -63.38 -27.25 69.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.301 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.421 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -82.6 -179.19 7.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.27 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.408 ' N ' HD13 ' A' ' 21' ' ' LEU . 6.4 mp -124.73 143.89 50.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.007 0.432 . . . . 0.0 111.345 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -81.44 148.78 29.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.407 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.431 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 49.8 pt -130.96 162.89 38.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.262 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -116.29 171.51 7.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.811 0.339 . . . . 0.0 110.873 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 16.1 ptpt -69.45 -10.99 60.42 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.7 p-10 -138.46 25.32 2.65 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.714 -0.395 . . . . 0.0 111.366 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.417 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 78.6 tt0 -101.08 139.16 37.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.783 0.325 . . . . 0.0 111.162 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.44 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 35.8 ptt180 -99.01 121.25 40.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.95 0.405 . . . . 0.0 111.305 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.493 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 0.5 OUTLIER -115.28 153.98 29.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.555 -179.564 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -101.96 112.31 24.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.687 0.28 . . . . 0.0 111.517 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.448 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 40.2 mt -78.19 145.03 35.82 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.928 0.394 . . . . 0.0 111.455 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.8 mp -111.27 -27.09 8.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.324 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -157.52 115.93 3.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.853 0.359 . . . . 0.0 111.038 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.434 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -107.14 4.14 26.5 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.3 t -68.94 -36.66 78.22 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.865 0.364 . . . . 0.0 111.441 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -81.83 159.18 23.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.859 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 86.1 m -59.82 -35.66 75.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.194 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.492 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 8.8 m0 -99.99 125.2 45.99 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.434 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 42.5 m0 -94.96 138.44 32.69 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.431 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 66.6 ttt180 -91.83 137.54 32.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.493 ' CG2' ' HB3' ' A' ' 29' ' ' LEU . 0.6 OUTLIER -140.4 161.44 24.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.619 -0.433 . . . . 0.0 112.134 -178.146 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 46.1 ttp180 -123.48 143.88 49.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.784 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -111.2 162.88 14.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.431 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.9 -19.89 20.23 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.739 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.25 6.0 15.43 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 69.96 24.77 5.05 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-O 120.786 0.327 . . . . 0.0 110.983 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -111.09 128.77 55.99 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.048 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 72.8 p -116.91 156.82 26.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.926 0.393 . . . . 0.0 111.16 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.59 178.4 43.91 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.038 -0.601 . . . . 0.0 112.087 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.431 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 97.1 m-85 -106.86 112.31 25.22 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.924 0.392 . . . . 0.0 111.109 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.7 t -124.54 112.16 27.7 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.658 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.492 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 7.5 Cg_exo -72.9 36.6 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.514 2.143 . . . . 0.0 112.759 178.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.439 ' O ' HG13 ' A' ' 56' ' ' VAL . 61.9 p -65.06 97.72 0.26 Allowed 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 120.599 0.238 . . . . 0.0 110.899 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -80.73 -3.68 51.7 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.078 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.543 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 81.1 m-85 -76.74 -1.61 28.88 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.439 HG13 ' O ' ' A' ' 53' ' ' SER . 7.3 p -111.66 142.03 25.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 121.076 0.465 . . . . 0.0 110.859 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.42 ' N ' HG21 ' A' ' 56' ' ' VAL . 83.9 tt0 -125.86 145.4 50.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.028 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.425 ' HG2' ' CG1' ' A' ' 7' ' ' VAL . 64.6 mtp180 -69.3 135.69 50.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.962 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.2 mttp . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.865 179.404 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.6 t . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 120.955 0.407 . . . . 0.0 111.362 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.3 mt -117.54 123.53 71.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.638 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 29.8 m -134.37 159.6 41.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.221 0.534 . . . . 0.0 112.053 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 24.2 mt -117.15 127.13 74.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.093 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.38 148.72 43.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.95 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -113.85 -16.48 12.23 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.589 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.486 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 11.6 m-90 -145.21 148.39 33.48 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.913 0.387 . . . . 0.0 110.325 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -68.49 126.51 29.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.667 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.409 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 45.7 t80 -127.25 135.78 51.09 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.163 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.3 m -105.52 120.77 42.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.026 0.441 . . . . 0.0 110.081 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.493 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . . . -52.92 143.46 16.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.048 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -129.51 40.45 3.59 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.185 0.517 . . . . 0.0 111.473 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.495 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 86.8 mm-40 -135.52 176.41 8.7 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.861 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -78.24 -38.68 42.41 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -122.95 77.69 1.48 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.218 0.532 . . . . 0.0 109.94 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.582 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -138.95 -179.39 5.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.408 -177.715 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.429 HD21 ' HB2' ' A' ' 43' ' ' ASN . 8.9 mp -137.01 137.39 39.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.101 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.9 p-10 -80.18 150.07 30.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.995 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.409 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 46.4 pt -129.44 164.17 32.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 120.655 0.264 . . . . 0.0 110.7 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -112.91 -177.59 3.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.28 0.562 . . . . 0.0 111.451 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -61.44 -52.25 65.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.827 -178.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -105.91 -7.89 17.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.419 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 80.5 tt0 -54.67 146.21 17.3 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.789 0.328 . . . . 0.0 111.515 -179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 -107.32 125.48 51.23 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.446 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.45 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 0.5 OUTLIER -116.26 156.24 26.94 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.796 0.331 . . . . 0.0 110.738 179.737 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -104.68 106.61 17.18 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.647 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.502 ' HA ' HG22 ' A' ' 41' ' ' VAL . 25.9 mt -68.53 143.42 54.94 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.513 0.673 . . . . 0.0 112.13 -178.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.485 HD21 ' N ' ' A' ' 32' ' ' LEU . 3.9 mm? -112.48 -35.86 5.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.631 -178.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -157.15 115.33 3.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.432 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.421 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 38.4 p-10 -111.99 4.31 18.04 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.3 m -67.47 -39.3 85.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.791 0.329 . . . . 0.0 111.606 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -81.27 159.59 24.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.782 -179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -35.24 68.61 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.444 ' CE3' ' HG3' ' A' ' 52' ' ' PRO . 16.8 m95 -96.22 131.18 42.97 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 177.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.421 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -104.07 135.44 45.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.168 0.509 . . . . 0.0 112.313 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.416 ' HA ' ' O ' ' A' ' 49' ' ' GLY . 75.2 ttt180 -94.65 130.29 41.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 31' ' ' LEU . 1.4 p -137.03 157.3 35.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -120.55 141.58 50.13 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.075 -178.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.429 ' HB2' HD21 ' A' ' 21' ' ' LEU . 60.3 t30 -113.18 163.18 15.09 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.676 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.73 -18.94 5.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.17 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.43 6.43 10.24 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 66.05 26.1 10.81 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.052 0.453 . . . . 0.0 111.043 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -112.32 143.55 43.24 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.463 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 73.1 p -132.76 161.61 33.61 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.791 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.582 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -177.81 -176.34 45.74 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.966 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.421 ' O ' ' HB3' ' A' ' 20' ' ' GLU . 93.6 m-85 -110.69 115.19 29.14 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -178.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.4 m -137.91 112.75 8.97 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.971 178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.444 ' HG3' ' CE3' ' A' ' 38' ' ' TRP . 2.7 Cg_exo -74.77 56.35 4.09 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.145 1.897 . . . . 0.0 111.371 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.08 82.24 1.27 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.073 0.463 . . . . 0.0 111.707 -178.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -64.64 -14.78 59.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.638 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.486 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.6 m-85 -71.1 -7.17 44.72 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.3 p -110.03 146.58 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.94 0.4 . . . . 0.0 110.888 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -136.59 162.43 33.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.506 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -69.39 140.89 54.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.771 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.979 179.853 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.464 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 57.9 t . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.744 0.307 . . . . 0.0 110.251 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.1 mt -103.11 119.25 51.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.665 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 35.1 m -132.29 160.24 42.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.564 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 26.0 mm -118.48 123.96 72.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.922 0.392 . . . . 0.0 111.329 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.38 120.52 21.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.514 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -93.01 -6.74 47.64 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.565 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 6.8 m-90 -143.99 143.78 31.37 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.796 0.331 . . . . 0.0 110.399 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -71.38 121.66 18.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.048 0.451 . . . . 0.0 111.722 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.418 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 54.2 t80 -127.18 135.52 50.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.692 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.4 m -102.73 141.73 35.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.016 0.436 . . . . 0.0 110.93 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.485 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -55.76 135.17 51.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.675 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -84.97 -4.87 59.31 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.697 0.284 . . . . 0.0 110.959 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.431 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 74.9 mt-30 -143.9 171.73 13.83 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -76.37 -28.79 56.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.894 0.378 . . . . 0.0 111.775 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -81.36 -6.7 59.19 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.536 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 1.1 mt-10 -86.04 179.09 7.04 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.736 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.438 HD23 ' N ' ' A' ' 43' ' ' ASN . 28.8 tp -124.27 126.57 46.29 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.997 0.427 . . . . 0.0 111.672 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -68.95 149.51 48.76 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.027 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 46.4 pt -134.88 165.24 31.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.249 179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -118.88 166.97 12.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.055 0.455 . . . . 0.0 111.353 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.407 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 55.4 pttt -67.22 -12.56 60.38 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -139.73 21.4 2.5 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.364 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -97.88 141.15 31.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.901 0.381 . . . . 0.0 110.636 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.9 ptt-85 -98.72 120.63 39.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.571 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.435 ' N ' ' CD2' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -113.75 148.17 36.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.032 0.444 . . . . 0.0 111.693 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 15.8 m-90 -99.83 111.31 23.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.979 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.464 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 62.4 mt -72.95 147.32 45.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.809 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mp -109.51 -30.89 7.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.415 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -133.72 -66.37 0.64 Allowed 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 120.809 0.338 . . . . 0.0 111.483 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.461 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 3.2 p30 51.6 16.41 0.45 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.621 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.6 m -77.93 -35.87 50.01 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.912 0.387 . . . . 0.0 110.89 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.4 mmtt -92.34 175.3 6.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.646 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.9 m -59.15 -27.86 66.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.723 178.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.477 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 49.4 m95 -99.75 127.64 45.88 Favored 'General case' 0 CA--C 1.522 -0.114 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 177.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.461 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 38.4 m0 -108.23 128.51 54.78 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -176.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.452 ' HB2' ' CE1' ' A' ' 50' ' ' TYR . 23.5 ttm180 -87.84 135.94 33.17 Favored 'General case' 0 C--O 1.231 0.087 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 177.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.4 p -145.36 161.9 12.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.221 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -120.84 144.06 48.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.009 0.433 . . . . 0.0 111.606 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.438 ' N ' HD23 ' A' ' 21' ' ' LEU . 55.9 t30 -114.33 161.12 18.31 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.319 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.38 -20.39 29.25 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.816 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.85 6.4 13.24 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 67.69 26.02 7.99 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.062 0.458 . . . . 0.0 111.121 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 85.6 mtt-85 -111.72 128.54 56.12 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.647 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 30.5 p -125.61 151.4 46.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.336 -179.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.536 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -172.47 172.64 45.04 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.685 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 40' ' ' ARG . 52.6 m-85 -96.75 108.55 21.22 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.2 m -126.91 111.36 22.06 Favored Pre-proline 0 C--N 1.333 -0.116 0 CA-C-N 116.794 -0.185 . . . . 0.0 111.208 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.477 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 60.5 Cg_endo -72.23 46.46 0.93 Allowed 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 121.788 1.659 . . . . 0.0 111.733 178.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.418 ' HB3' ' CD1' ' A' ' 13' ' ' TYR . 9.1 p -72.99 81.62 1.21 Allowed 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 120.973 0.416 . . . . 0.0 111.112 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 p30 -58.05 -19.45 31.67 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.113 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.565 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.6 m-85 -57.22 -16.92 9.36 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.724 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -108.98 140.57 27.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.045 0.45 . . . . 0.0 110.859 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -135.42 162.56 32.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.026 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -70.08 139.14 52.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.912 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.3 tttp . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.953 -179.929 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.2 t . . . . . 0 N--CA 1.455 -0.208 0 CA-C-O 120.711 0.291 . . . . 0.0 110.428 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.1 mt -109.81 119.79 59.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.249 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.1 m -134.03 161.11 41.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.85 0.357 . . . . 0.0 111.244 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.2 mm -115.89 121.95 68.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.034 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.12 126.77 31.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.722 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -99.67 -10.6 21.76 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.563 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.3 m-90 -141.96 145.26 34.3 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.839 0.352 . . . . 0.0 110.462 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -72.53 122.64 21.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.627 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.402 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 55.8 t80 -127.71 139.03 52.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.723 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.3 m -103.14 134.47 46.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.001 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.43 142.26 39.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.965 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -88.75 -4.56 58.49 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -149.45 176.95 10.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.637 0.256 . . . . 0.0 110.662 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -75.78 -34.18 60.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.127 0.489 . . . . 0.0 110.694 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -62.45 -35.98 81.0 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.146 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.671 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 0.9 OUTLIER -81.7 178.61 8.23 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.469 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.2 mp -126.12 161.33 27.88 Favored 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 121.32 0.581 . . . . 0.0 112.093 -178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -90.53 148.1 22.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.162 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.402 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 40.2 pt -130.06 163.21 36.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.42 ' HG2' ' N ' ' A' ' 25' ' ' LYS . 86.4 tttt -117.72 164.54 14.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.991 0.424 . . . . 0.0 111.277 -178.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.422 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 11.0 ptpp? -63.31 -12.89 33.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -137.75 5.55 2.64 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -77.27 146.79 36.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.753 0.311 . . . . 0.0 110.599 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -94.96 119.64 33.83 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 120.979 0.418 . . . . 0.0 110.875 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.53 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.6 mm? -113.77 142.41 46.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.468 -179.183 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -103.32 109.63 21.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.695 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.6 mt -79.68 151.12 30.67 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.312 0.577 . . . . 0.0 111.67 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.52 HD11 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -114.99 -29.01 6.82 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.804 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -161.4 118.36 2.23 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.363 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.435 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.1 p-10 -110.33 2.89 19.38 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.6 m -63.58 -38.9 92.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.955 0.407 . . . . 0.0 111.367 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -82.8 159.49 22.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.675 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.08 -35.6 71.62 Favored 'General case' 0 C--O 1.23 0.065 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.443 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 45.1 m95 -94.85 132.05 40.08 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.435 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 40.1 m0 -105.9 132.47 51.97 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -177.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -86.87 131.96 33.96 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.53 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.6 p -140.7 159.56 24.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -177.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -123.79 141.78 51.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.568 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -110.38 162.26 14.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.588 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.36 -19.93 39.57 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.587 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.79 5.01 14.67 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.8 t30 71.88 26.4 2.96 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 110.886 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -112.47 133.98 54.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.127 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 73.5 p -124.58 148.1 48.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.901 0.381 . . . . 0.0 111.205 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.671 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -163.23 -178.67 37.17 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.628 -179.468 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -113.27 97.05 6.24 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.462 ' CG1' ' HB2' ' A' ' 20' ' ' GLU . 0.2 OUTLIER -112.97 121.11 39.13 Favored Pre-proline 0 C--N 1.329 -0.315 0 C-N-CA 121.341 -0.144 . . . . 0.0 110.753 178.288 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.443 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 96.0 Cg_endo -78.26 43.33 1.39 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.018 1.812 . . . . 0.0 111.697 177.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.01 87.84 0.75 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.868 0.366 . . . . 0.0 111.343 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -68.32 -11.63 59.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.524 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.563 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 98.7 m-85 -69.09 -10.47 57.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.3 p -114.86 141.49 31.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.996 0.427 . . . . 0.0 110.691 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -146.88 161.58 40.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.858 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.478 ' HG2' ' HG2' ' A' ' 59' ' ' LYS . 79.5 ttt-85 -69.84 138.84 52.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.881 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.478 ' HG2' ' HG2' ' A' ' 58' ' ' ARG . 74.6 mmtt . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.916 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.2 t . . . . . 0 N--CA 1.452 -0.327 0 CA-C-O 120.82 0.343 . . . . 0.0 110.472 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.0 mm -97.05 118.45 43.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.166 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 30.5 m -134.33 162.86 38.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.184 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 26.8 mm -120.96 130.38 74.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.035 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.18 150.92 38.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.844 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -117.09 -14.17 10.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.748 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 8.6 m-90 -148.69 149.98 32.4 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.93 0.395 . . . . 0.0 110.962 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -74.18 121.92 21.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.14 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -127.4 137.43 52.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.997 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.3 m -99.76 137.32 38.4 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.287 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.418 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -51.19 129.57 24.64 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.927 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -62.4 -23.74 67.0 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.985 0.422 . . . . 0.0 110.449 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -139.47 172.91 12.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.071 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -72.8 -29.39 63.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.926 0.393 . . . . 0.0 111.482 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -72.12 -17.46 61.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.911 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.514 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 1.0 OUTLIER -86.22 179.61 6.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.725 0.298 . . . . 0.0 110.327 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.3 tp -118.9 143.57 46.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.22 -179.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -86.0 151.66 23.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.654 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.4 HG23 HD11 ' A' ' 29' ' ' LEU . 33.7 pt -134.07 162.48 39.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.73 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -114.22 -176.95 3.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.195 0.522 . . . . 0.0 111.24 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -63.56 -52.95 58.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.427 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -109.1 -0.17 19.55 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.414 ' HG2' HD22 ' A' ' 29' ' ' LEU . 66.6 tt0 -57.4 142.48 43.65 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.943 0.401 . . . . 0.0 111.404 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -94.7 122.29 37.16 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.343 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.478 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 3.8 mm? -111.38 145.43 38.9 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 26.6 m-90 -105.47 108.44 19.95 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.554 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.648 ' CD1' ' HD2' ' A' ' 34' ' ' ASP . 68.1 mt -72.16 147.42 46.63 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.071 0.463 . . . . 0.0 111.891 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.442 HD11 ' HA ' ' A' ' 41' ' ' VAL . 5.4 mp -112.6 -28.52 7.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.255 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -158.51 116.41 2.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.804 0.335 . . . . 0.0 111.101 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.648 ' HD2' ' CD1' ' A' ' 31' ' ' LEU . 96.4 m-20 -110.08 9.12 24.15 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.195 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 87.9 p -77.19 -35.13 56.06 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.923 0.392 . . . . 0.0 110.99 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -82.79 157.44 23.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.424 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -58.44 -36.78 74.18 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.438 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 15.2 m95 -95.51 130.17 42.44 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 177.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.428 ' CZ2' ' HB3' ' A' ' 34' ' ' ASP . 32.3 m0 -100.91 134.41 43.94 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.16 0.505 . . . . 0.0 112.277 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 73.5 ttt180 -92.79 133.06 36.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 177.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.478 ' CG2' ' HB3' ' A' ' 29' ' ' LEU . 1.2 p -140.48 147.05 23.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.929 -177.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.432 ' CB ' ' HB ' ' A' ' 48' ' ' THR . 58.8 ttt180 -118.54 153.3 34.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.653 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 53.4 p-10 -122.49 171.8 8.83 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.033 0.444 . . . . 0.0 111.808 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.36 -15.08 46.34 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.174 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.88 6.08 10.01 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 66.32 23.18 10.76 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.885 0.374 . . . . 0.0 111.269 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -119.53 129.41 54.67 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.432 ' HB ' ' CB ' ' A' ' 42' ' ' ARG . 5.7 t -135.99 155.85 49.63 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.684 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.514 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.81 -173.66 36.06 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 120.628 -0.796 . . . . 0.0 113.021 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 40' ' ' ARG . 98.1 m-85 -99.66 107.62 19.78 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 20.5 t -125.56 119.83 24.6 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.276 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.438 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 77.4 Cg_endo -83.21 39.63 0.84 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.217 1.945 . . . . 0.0 111.733 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.6 p -68.5 90.05 0.37 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.877 0.37 . . . . 0.0 111.617 -179.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -65.94 -13.59 60.04 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.45 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -60.22 -14.4 17.49 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.7 p -111.08 147.16 15.29 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 120.847 0.356 . . . . 0.0 110.759 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -146.07 164.9 30.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.64 -179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -68.4 141.86 55.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.332 . . . . 0.0 110.562 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.249 -0.881 . . . . 0.0 110.969 179.959 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 68.5 t . . . . . 0 N--CA 1.456 -0.174 0 CA-C-O 120.743 0.306 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.4 mt -112.87 119.0 59.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.848 0.356 . . . . 0.0 111.403 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.2 m -132.68 161.65 41.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.07 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 30.7 mt -117.43 129.38 74.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.957 0.408 . . . . 0.0 111.339 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.85 148.29 38.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.362 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -113.31 -17.81 12.21 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.693 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.452 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.9 m-90 -143.62 134.54 25.4 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.965 0.412 . . . . 0.0 111.014 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -60.04 125.32 23.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.626 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -127.54 141.32 51.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.982 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 86.8 m -106.38 138.35 42.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.404 179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.453 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -55.92 132.27 49.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.728 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.474 ' HB2' ' HE2' ' A' ' 20' ' ' GLU . 97.4 mt-30 -66.79 -24.67 66.21 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.138 0.494 . . . . 0.0 110.58 179.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -136.12 170.67 15.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.103 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -72.46 -28.11 62.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.79 0.328 . . . . 0.0 111.168 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -69.96 -21.2 63.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.794 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.474 ' HE2' ' HB2' ' A' ' 16' ' ' GLN . 0.8 OUTLIER -82.9 -179.24 7.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.839 0.352 . . . . 0.0 110.556 179.901 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.7 tp -118.1 139.92 50.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.323 -178.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -83.54 140.67 32.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.422 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.3 pt -126.56 165.39 24.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.53 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.4 mttm -114.35 -178.68 3.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.12 0.486 . . . . 0.0 111.523 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -64.01 -52.14 60.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.396 -178.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -106.44 -6.42 18.21 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.78 146.75 30.36 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.918 0.39 . . . . 0.0 111.022 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.7 mtm105 -101.3 124.86 47.66 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.875 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.457 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 1.3 mm? -114.32 149.78 35.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.157 0.503 . . . . 0.0 111.644 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.2 m-90 -102.17 115.73 31.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.419 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.484 ' HA ' HG23 ' A' ' 41' ' ' VAL . 40.6 mt -79.88 146.22 32.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.367 0.603 . . . . 0.0 112.337 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.7 mt -108.94 -35.0 6.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.308 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.58 ' HD2' ' HB2' ' A' ' 35' ' ' SER . 53.1 t0 -159.61 117.59 2.73 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.11 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.419 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.8 p-10 -107.41 4.94 26.84 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.163 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.58 ' HB2' ' HD2' ' A' ' 33' ' ' ASP . 71.9 m -69.11 -36.56 77.67 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.776 0.322 . . . . 0.0 111.696 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -84.06 156.84 22.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.101 0.477 . . . . 0.0 112.035 -179.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 60.2 m -55.75 -31.29 62.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.368 177.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.2 m95 -101.59 134.25 45.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.427 ' CE3' HD22 ' A' ' 31' ' ' LEU . 37.5 m0 -103.82 138.01 41.02 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -97.13 130.45 44.39 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.484 HG23 ' HA ' ' A' ' 31' ' ' LEU . 0.5 OUTLIER -139.56 148.62 23.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 120.59 -0.444 . . . . 0.0 112.023 -177.73 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -122.99 146.53 47.54 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.886 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -113.44 171.2 7.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.038 0.447 . . . . 0.0 112.022 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.22 -16.2 31.37 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.991 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.61 5.04 16.61 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 69.93 22.09 6.0 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.75 0.309 . . . . 0.0 111.143 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -116.46 128.62 55.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.11 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.5 t -134.04 151.46 51.43 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.318 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.434 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -160.77 -173.43 29.36 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.807 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -100.06 104.55 16.13 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 111.106 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.3 t -123.88 112.29 28.84 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.023 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.8 44.34 1.27 Allowed 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 121.794 1.662 . . . . 0.0 111.437 177.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.9 p -72.92 81.97 1.2 Allowed 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 120.88 0.371 . . . . 0.0 111.467 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -64.76 -13.36 54.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.338 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.452 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.9 m-85 -62.94 -10.92 15.35 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.3 p -108.82 141.78 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-O 121.05 0.453 . . . . 0.0 111.033 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -130.17 158.46 39.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.651 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 24.3 ttm105 -70.22 129.65 39.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.925 0.393 . . . . 0.0 111.25 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.251 179.723 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.513 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 99.6 t . . . . . 0 C--O 1.233 0.186 0 CA-C-O 120.752 0.31 . . . . 0.0 110.586 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mt -101.08 119.12 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.877 0.37 . . . . 0.0 111.235 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.96 163.03 38.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.545 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.438 HD11 ' HD2' ' A' ' 59' ' ' LYS . 47.3 mt -122.89 127.59 74.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.77 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.08 145.25 44.57 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.952 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -108.83 -18.01 13.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.887 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.516 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 9.7 m-90 -143.87 147.54 34.19 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.844 0.354 . . . . 0.0 111.595 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.453 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 60.5 t0 -69.89 123.14 20.73 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.179 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.404 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 65.1 t80 -128.52 134.88 48.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.666 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 92.6 m -99.5 140.97 32.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.413 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.463 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -53.37 131.49 37.87 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.599 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -67.41 -18.32 65.07 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.384 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -142.6 173.7 11.3 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -76.24 -22.27 55.36 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.678 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -82.11 -7.04 59.6 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.463 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 1.1 mt-10 -92.88 -179.96 5.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.92 0.39 . . . . 0.0 110.744 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.435 HD22 ' N ' ' A' ' 43' ' ' ASN . 46.3 tp -116.59 140.51 49.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.554 -178.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -85.62 150.06 24.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.837 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.404 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 31.2 pt -134.71 164.1 34.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.339 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -116.13 -175.87 2.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.916 0.389 . . . . 0.0 111.486 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.516 ' HD3' ' HA ' ' A' ' 11' ' ' TRP . 13.9 mmtt -64.67 -48.17 75.72 Favored 'General case' 0 C--N 1.334 -0.097 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -112.8 -4.72 13.96 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.424 ' HG2' HD21 ' A' ' 29' ' ' LEU . 73.0 tt0 -58.51 143.03 47.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.905 0.384 . . . . 0.0 111.422 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.414 ' NE ' HD12 ' A' ' 8' ' ' ILE . 90.7 mtt180 -99.74 126.12 45.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.628 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.485 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.3 mm? -114.67 146.45 40.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.002 0.429 . . . . 0.0 111.731 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -103.5 107.03 17.7 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.268 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.513 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 66.3 mt -72.9 148.54 44.26 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.117 0.485 . . . . 0.0 111.652 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.524 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -111.97 -29.01 7.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.023 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -158.97 116.97 2.86 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.52 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.432 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 36.6 p-10 -111.26 9.31 21.71 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.2 p -70.28 -36.71 74.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.919 0.39 . . . . 0.0 111.181 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -85.13 155.93 21.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.557 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -35.39 61.36 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.5 m95 -95.62 135.34 37.43 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.432 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 41.9 m0 -109.13 133.17 53.36 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -177.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.434 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 46.4 ttt180 -87.53 134.44 33.61 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.524 ' HA ' HD13 ' A' ' 32' ' ' LEU . 1.5 p -145.78 157.35 12.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.824 -178.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -121.27 143.46 49.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.389 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.435 ' N ' HD22 ' A' ' 21' ' ' LEU . 54.3 t30 -113.49 161.74 16.99 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.372 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.94 -21.33 29.25 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.546 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.76 5.76 10.54 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.9 m120 68.54 23.73 7.24 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 120.841 0.353 . . . . 0.0 111.046 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -108.86 128.54 55.0 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.121 -0.491 . . . . 0.0 109.816 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 81.7 p -119.67 150.41 40.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.067 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.443 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -169.23 171.68 43.14 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.459 -0.876 . . . . 0.0 113.217 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.434 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.5 m-85 -102.68 106.37 17.0 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.574 0.225 . . . . 0.0 111.493 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.1 m -123.08 119.21 27.8 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.327 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -77.31 33.11 0.43 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.147 1.898 . . . . 0.0 112.067 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.8 p -59.1 100.78 0.08 Allowed 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.644 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -81.4 -4.65 56.39 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 177.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -72.65 -7.61 51.21 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.538 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.7 p -118.81 142.43 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 CA-C-O 120.936 0.398 . . . . 0.0 110.563 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -141.32 161.22 38.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.754 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -69.93 134.72 48.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.027 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.438 ' HD2' HD11 ' A' ' 8' ' ' ILE . 79.8 tttt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.791 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.453 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.0 t . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 120.722 0.296 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mm -103.21 109.86 28.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.414 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.4 ' CG2' HG22 ' A' ' 56' ' ' VAL . 13.1 m -128.85 162.23 36.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.771 0.319 . . . . 0.0 111.444 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 22.8 mt -124.06 122.89 65.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.821 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.59 117.03 17.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.391 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -91.53 -5.35 54.27 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.538 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.2 m-90 -144.65 142.04 29.81 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.906 0.384 . . . . 0.0 110.528 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -70.09 120.39 15.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.584 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.418 ' CD1' ' HB2' ' A' ' 53' ' ' SER . 49.4 t80 -127.27 134.13 50.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.556 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.3 m -101.25 141.95 33.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.942 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.466 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.06 135.56 56.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.703 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -83.27 -4.52 58.51 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.074 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.04 168.47 19.93 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.071 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -73.82 -35.34 64.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.443 . . . . 0.0 112.171 -178.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -76.15 -9.72 58.85 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.346 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.703 ' HE2' ' HZ3' ' A' ' 38' ' ' TRP . 0.8 OUTLIER -82.4 -178.52 7.09 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.008 0.432 . . . . 0.0 110.855 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.478 HD22 HG11 ' A' ' 41' ' ' VAL . 8.9 tp -122.82 138.94 54.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.79 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -83.0 149.08 27.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.439 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.402 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 38.8 pt -134.22 160.8 41.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.332 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -116.0 168.16 10.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.09 0.471 . . . . 0.0 111.32 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.405 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 47.3 pttt -67.36 -11.43 57.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.055 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -141.11 27.24 1.97 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.156 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -102.44 135.64 43.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.791 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.6 mtt85 -86.66 119.96 27.46 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.02 0.438 . . . . 0.0 110.852 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.595 ' HB3' HG23 ' A' ' 41' ' ' VAL . 2.3 mm? -111.05 143.1 42.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.456 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.0 m-90 -104.32 105.28 15.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.325 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.453 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 25.3 mt -80.64 148.79 30.09 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.929 0.395 . . . . 0.0 111.091 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 41' ' ' VAL . 4.3 mp -110.19 -26.17 9.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.213 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -158.59 115.44 2.79 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.767 0.318 . . . . 0.0 111.042 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.405 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 31.9 p-10 -112.24 16.76 19.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.828 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.0 p -78.95 -36.68 41.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.988 0.423 . . . . 0.0 110.976 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -85.29 161.58 19.46 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.771 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 20.7 p -55.74 -41.03 73.34 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.703 ' HZ3' ' HE2' ' A' ' 20' ' ' GLU . 49.8 m95 -92.48 133.45 35.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.165 178.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.428 ' CE3' HD11 ' A' ' 31' ' ' LEU . 38.4 m0 -106.89 132.59 52.67 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -86.97 132.94 33.64 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.595 HG23 ' HB3' ' A' ' 29' ' ' LEU . 4.2 p -149.0 155.32 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -177.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -124.07 147.15 48.1 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.942 0.401 . . . . 0.0 111.691 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.412 ' HB2' HD21 ' A' ' 21' ' ' LEU . 39.7 t30 -111.19 164.69 12.61 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.699 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.78 -17.99 61.97 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.677 177.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.18 5.89 15.56 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.011 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 68.31 25.18 7.15 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.773 0.32 . . . . 0.0 111.713 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 82.1 mtt85 -111.56 128.72 56.12 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 178.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 77.8 p -117.42 153.87 32.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.967 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.473 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -171.87 168.83 41.96 Favored Glycine 0 CA--C 1.524 0.635 0 C-N-CA 120.512 -0.852 . . . . 0.0 113.567 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -103.33 105.91 16.3 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.1 m -127.19 112.85 21.56 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 111.604 0.224 . . . . 0.0 111.604 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.414 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 11.8 Cg_exo -71.16 36.23 0.29 Allowed 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 122.6 2.2 . . . . 0.0 112.683 178.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.418 ' HB2' ' CD1' ' A' ' 13' ' ' TYR . 41.8 t -67.0 93.45 0.28 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.022 0.439 . . . . 0.0 111.897 -178.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -71.07 -9.71 58.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.365 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.538 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.7 m-85 -64.38 -13.34 50.27 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.993 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.4 HG22 ' CG2' ' A' ' 7' ' ' VAL . 5.8 p -116.16 143.72 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.12 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -148.56 160.29 43.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.896 0.379 . . . . 0.0 111.357 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -72.27 134.81 45.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.4 mttt . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.522 179.134 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.479 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.0 t . . . . . 0 N--CA 1.456 -0.164 0 CA-C-O 120.74 0.305 . . . . 0.0 110.358 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 8.1 mt -103.91 120.39 54.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.388 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 21.0 m -132.41 160.03 42.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.571 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.466 ' HA ' ' HA ' ' A' ' 28' ' ' ARG . 51.7 mt -117.82 122.75 70.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.08 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.84 122.2 23.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.139 0.495 . . . . 0.0 111.71 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -91.39 -2.81 57.21 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.38 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.538 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 8.4 m-90 -145.66 143.51 29.86 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.779 0.323 . . . . 0.0 110.949 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.9 p-10 -72.4 122.71 21.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.198 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.415 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 62.4 t80 -128.39 140.47 51.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.17 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.3 m -100.82 136.18 41.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.61 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.458 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -56.97 134.67 55.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.351 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -65.73 -34.33 77.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.086 0.469 . . . . 0.0 110.272 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -128.8 168.38 15.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.233 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -68.01 -34.34 76.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.978 0.418 . . . . 0.0 111.164 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -62.89 -26.26 68.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.085 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.458 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -80.64 -178.68 6.86 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.509 HD23 ' HB2' ' A' ' 43' ' ' ASN . 7.3 mp -124.62 145.52 49.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.587 -178.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -83.64 149.81 26.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.028 178.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.448 HD13 ' CB ' ' A' ' 53' ' ' SER . 43.8 pt -130.79 166.12 29.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.159 179.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -120.3 166.76 13.07 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.287 0.565 . . . . 0.0 110.962 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 21.2 pttp -66.61 -12.9 60.1 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.739 -179.256 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -135.4 22.07 3.42 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.208 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -101.08 143.42 31.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.875 0.369 . . . . 0.0 110.592 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.466 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 26.3 ptt85 -102.86 128.35 49.67 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.935 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.489 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 0.7 OUTLIER -115.81 151.76 34.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.189 -178.968 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 8.7 m-90 -100.51 110.63 22.81 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.046 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.487 ' HA ' HG21 ' A' ' 41' ' ' VAL . 86.7 mt -75.41 145.65 41.41 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.946 0.403 . . . . 0.0 111.573 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.407 HD11 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -111.69 -29.87 7.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.007 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.568 ' HD2' ' HB2' ' A' ' 35' ' ' SER . 54.2 t0 -161.02 119.86 2.53 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.863 0.363 . . . . 0.0 110.952 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.417 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.4 p-10 -106.44 1.97 26.0 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.568 ' HB2' ' HD2' ' A' ' 33' ' ' ASP . 73.3 m -64.9 -39.17 93.11 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -81.32 158.79 24.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.195 0.521 . . . . 0.0 112.192 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 94.2 m -58.64 -36.22 73.77 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.024 178.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.503 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 21.1 m95 -99.37 125.41 45.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.417 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 41.7 m0 -95.11 138.98 32.09 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -177.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -92.8 136.27 33.39 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 177.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.489 ' CG2' ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -141.51 159.68 21.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.834 -178.325 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -121.6 145.06 48.36 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.242 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.509 ' HB2' HD23 ' A' ' 21' ' ' LEU . 52.0 t30 -111.0 162.76 14.53 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.934 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.12 -23.15 45.06 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.852 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.52 5.46 7.32 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 179.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.3 m120 71.33 26.6 3.3 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 120.874 0.369 . . . . 0.0 110.714 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 25.9 mmt85 -106.34 145.75 31.28 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.765 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.4 p -135.21 148.84 49.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.723 0.297 . . . . 0.0 111.135 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.15 -172.03 36.95 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.851 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -108.89 112.35 24.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.712 0.291 . . . . 0.0 111.419 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.09 113.3 21.74 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.416 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.503 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 59.9 Cg_endo -76.94 31.11 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.414 2.076 . . . . 0.0 112.484 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.448 ' CB ' HD13 ' A' ' 23' ' ' ILE . 13.8 p -62.43 87.24 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.772 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -72.86 -8.12 54.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.517 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.538 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 99.6 m-85 -71.79 -1.29 13.54 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.5 p -111.04 144.78 18.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-O 120.877 0.37 . . . . 0.0 110.922 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -136.03 148.79 48.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.988 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.2 ttt-85 -70.43 138.97 51.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.868 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 62.3 tttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.861 179.638 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.426 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.7 t . . . . . 0 N--CA 1.455 -0.201 0 CA-C-O 120.738 0.304 . . . . 0.0 110.369 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.9 mt -104.5 121.08 55.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.842 0.353 . . . . 0.0 110.939 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 27.2 m -132.34 162.72 39.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.964 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 24.3 mt -116.76 128.46 74.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.642 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.63 146.75 44.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.037 0.446 . . . . 0.0 111.119 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.9 mtpp -110.25 -21.9 12.01 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.328 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.498 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.9 m-90 -137.47 142.08 41.55 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.164 0.507 . . . . 0.0 110.975 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -65.37 127.1 30.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.535 -179.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.449 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 68.0 t80 -128.47 140.24 51.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.707 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.9 m -101.91 134.12 45.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.737 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.423 ' CB ' ' HG3' ' A' ' 20' ' ' GLU . . . -51.87 128.23 23.4 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.35 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -67.82 -24.26 65.27 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.953 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -146.42 171.47 14.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.919 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -67.19 -35.04 78.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.928 0.394 . . . . 0.0 111.585 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -58.17 -40.43 81.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.058 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.657 ' HE2' ' HZ3' ' A' ' 38' ' ' TRP . 5.5 pt-20 -83.41 -179.55 7.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.075 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.431 HD13 ' N ' ' A' ' 21' ' ' LEU . 8.6 mp -122.22 162.26 21.72 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -89.33 144.43 26.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.92 178.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.449 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 34.6 pt -128.95 163.98 32.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.405 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 96.4 mttt -111.94 -179.12 3.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.339 0.59 . . . . 0.0 111.442 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -61.8 -51.99 66.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.808 -179.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -105.82 -7.46 18.29 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 74.9 tt0 -54.03 145.2 17.29 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.036 0.446 . . . . 0.0 111.363 -179.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -101.95 125.87 48.73 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.531 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.5 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 1.0 OUTLIER -114.6 146.88 40.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.33 -179.165 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -100.91 111.65 23.9 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.172 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.649 HD11 ' HD2' ' A' ' 34' ' ' ASP . 83.0 mt -76.32 143.73 40.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.758 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.496 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -111.46 -28.25 8.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.909 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -160.97 120.31 2.61 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.116 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.649 ' HD2' HD11 ' A' ' 31' ' ' LEU . 94.4 m-20 -109.17 5.2 23.69 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.942 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 t -69.62 -35.98 75.74 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.846 0.355 . . . . 0.0 111.427 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -83.23 157.4 22.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.668 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 90.5 m -56.83 -35.78 69.21 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.657 ' HZ3' ' HE2' ' A' ' 20' ' ' GLU . 16.3 m95 -98.89 131.54 44.9 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.425 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 43.5 m0 -101.47 134.25 44.85 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.419 0.525 . . . . 0.0 112.419 -177.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.437 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 46.2 ttt85 -88.08 131.81 34.54 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.337 178.393 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.5 ' CG2' ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -133.31 163.4 37.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.601 -178.522 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -126.77 140.9 52.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.367 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -108.82 162.99 13.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.823 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.73 -22.75 58.45 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.551 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.76 4.45 9.6 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.9 t30 74.31 24.17 1.91 Allowed 'General case' 0 C--N 1.342 0.258 0 C-N-CA 122.505 0.322 . . . . 0.0 110.952 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -105.59 142.83 34.65 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.097 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 78.4 p -132.82 147.05 52.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.803 0.335 . . . . 0.0 111.277 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.456 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -170.31 176.83 43.83 Favored Glycine 0 CA--C 1.523 0.567 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.557 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.437 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 96.1 m-85 -103.13 99.39 9.26 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.075 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 19.8 t -108.1 111.83 61.78 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.294 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.86 32.93 0.33 Allowed 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.132 1.888 . . . . 0.0 112.448 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.8 p -65.04 91.69 0.1 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.793 0.33 . . . . 0.0 111.344 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -72.6 -7.4 50.03 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.971 178.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.498 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.4 m-85 -66.81 -10.22 45.48 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.861 0.465 . . . . 0.0 112.231 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.5 p -115.49 143.63 24.92 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.122 0 CA-C-O 121.025 0.441 . . . . 0.0 110.805 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.28 157.24 46.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.528 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 73.8 ttp85 -79.73 132.08 36.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.95 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.3 mtmm . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.316 -0.849 . . . . 0.0 110.891 179.832 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.483 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 63.5 t . . . . . 0 CA--C 1.53 0.208 0 CA-C-O 120.732 0.301 . . . . 0.0 110.676 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.416 HD11 HG23 ' A' ' 6' ' ' ILE . 10.5 mt -104.07 121.0 55.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.286 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.44 ' CG1' ' HG2' ' A' ' 58' ' ' ARG . 22.2 m -132.55 162.35 39.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.809 0.338 . . . . 0.0 111.685 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.7 mt -123.62 120.61 60.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.85 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.6 129.24 37.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.643 -179.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -95.32 -6.57 40.93 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.367 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.479 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.1 m-90 -147.34 142.25 26.91 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.848 0.356 . . . . 0.0 110.85 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.43 122.25 20.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.42 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.404 ' CE1' ' O ' ' A' ' 14' ' ' THR . 60.2 t80 -127.46 138.37 52.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.511 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.404 ' O ' ' CE1' ' A' ' 13' ' ' TYR . 27.2 m -98.37 139.63 33.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.9 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.439 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -53.45 128.02 27.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.754 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -61.46 -33.0 73.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.204 0.526 . . . . 0.0 110.426 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -135.76 162.0 33.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.699 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -59.17 -35.69 73.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.918 0.39 . . . . 0.0 111.659 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -66.06 -20.29 66.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.6 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.439 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 2.3 mm-40 -81.74 -179.83 7.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.948 0.404 . . . . 0.0 110.259 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.402 HD23 ' CG1' ' A' ' 41' ' ' VAL . 9.2 tp -120.21 145.59 46.85 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.681 -178.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -86.71 146.35 26.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.575 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 29.5 pt -131.13 164.29 34.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.106 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -121.59 168.9 11.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.233 0.539 . . . . 0.0 111.067 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.471 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 53.9 pttt -67.1 -15.27 63.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.386 -0.824 . . . . 0.0 113.162 -178.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -139.01 23.61 2.59 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.534 -0.466 . . . . 0.0 111.213 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -99.85 139.1 36.0 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.113 0.482 . . . . 0.0 110.641 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 -92.65 121.43 34.07 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.76 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.465 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 0.5 OUTLIER -113.92 150.07 34.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.875 0.369 . . . . 0.0 110.683 -179.607 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -102.71 113.53 27.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.404 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.483 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 61.0 mt -78.78 143.41 36.12 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.053 0.454 . . . . 0.0 111.28 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.488 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -107.82 -28.18 9.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.78 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.588 ' HD2' ' HB3' ' A' ' 35' ' ' SER . 52.9 t0 -159.1 117.05 2.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.947 0.403 . . . . 0.0 110.889 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.426 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.9 p-10 -107.0 1.61 24.53 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.047 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.588 ' HB3' ' HD2' ' A' ' 33' ' ' ASP . 32.5 t -67.13 -37.76 84.39 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.88 0.371 . . . . 0.0 111.517 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -81.06 159.51 24.74 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.67 0.748 . . . . 0.0 112.779 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 16.9 p -56.96 -39.9 75.47 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.255 178.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -97.15 132.67 42.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.79 -1.095 . . . . 0.0 108.366 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.426 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 36.1 m0 -102.2 136.66 41.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -177.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 44.2 ttt180 -93.49 137.78 32.43 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 177.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.488 ' HA ' HD13 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -142.37 162.53 18.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.701 -0.4 . . . . 0.0 111.263 -178.316 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -125.04 143.41 50.93 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.041 0.448 . . . . 0.0 111.891 -178.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -110.61 164.64 12.53 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.923 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.61 -22.97 64.34 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.804 178.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.97 5.33 11.91 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.043 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 67.82 26.56 7.63 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.95 0.405 . . . . 0.0 111.271 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 27.1 ttm180 -110.4 127.65 55.19 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.3 p -122.72 152.62 40.4 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.832 0.349 . . . . 0.0 110.997 -179.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -168.22 173.1 43.01 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.524 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -100.92 107.16 18.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.916 0.389 . . . . 0.0 111.17 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.3 t -119.75 113.91 34.39 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.058 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.08 42.81 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 121.804 1.669 . . . . 0.0 111.82 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.403 ' O ' HG13 ' A' ' 56' ' ' VAL . 2.8 p -70.62 88.45 0.69 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.096 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -66.54 -13.98 61.71 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.124 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.479 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.8 m-85 -61.67 -15.45 40.2 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 53' ' ' SER . 7.4 p -107.07 141.85 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 120.984 0.421 . . . . 0.0 110.451 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -127.44 151.35 48.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.768 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.44 ' HG2' ' CG1' ' A' ' 7' ' ' VAL . 76.4 mtp180 -69.57 139.9 53.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.836 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.1 pttm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.909 179.259 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.427 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 77.9 t . . . . . 0 CA--C 1.528 0.121 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.5 mt -115.01 114.42 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.409 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 32.2 m -130.68 163.72 35.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.776 0.322 . . . . 0.0 111.55 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.7 mt -121.94 121.93 65.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.413 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.45 120.26 22.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.677 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -91.11 -7.71 50.88 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.562 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.606 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.8 m-90 -143.57 143.18 31.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.956 0.408 . . . . 0.0 110.705 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -72.08 120.47 17.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.129 0.49 . . . . 0.0 111.751 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.404 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 60.1 t80 -128.26 134.7 49.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.766 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.8 m -100.83 138.69 37.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.488 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.449 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -56.54 132.51 51.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.491 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.811 ' HB2' ' HE2' ' A' ' 20' ' ' GLU . 99.0 mm-40 -69.96 -16.06 63.14 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.998 179.191 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -141.64 172.89 12.06 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -74.38 -34.3 63.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.264 0.554 . . . . 0.0 110.533 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.77 -19.13 64.74 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.135 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.811 ' HE2' ' HB2' ' A' ' 16' ' ' GLN . 0.7 OUTLIER -86.4 -179.85 6.74 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.635 -179.264 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.412 ' CD2' ' HB2' ' A' ' 43' ' ' ASN . 28.6 tp -122.1 130.72 53.5 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -177.18 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -71.23 142.24 50.58 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.194 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.404 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 38.1 pt -129.03 164.48 31.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.374 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -120.98 167.02 13.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.227 0.537 . . . . 0.0 111.366 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.429 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 56.2 pttt -66.84 -12.91 60.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.334 -0.848 . . . . 0.0 113.101 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -141.52 28.35 1.82 Allowed 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -105.09 140.57 38.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.085 0.469 . . . . 0.0 110.928 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 -92.46 119.12 31.66 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.184 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.47 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.5 mm? -112.23 150.91 30.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.511 -179.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -107.2 106.49 16.99 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.612 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.485 ' HA ' HG22 ' A' ' 41' ' ' VAL . 39.3 mt -76.06 149.67 37.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.44 0.638 . . . . 0.0 111.334 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -112.19 -30.43 7.21 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.643 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.1 m-20 -157.04 113.91 3.05 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.529 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.431 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -106.49 2.47 26.29 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -65.18 -37.9 88.8 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 120.843 0.354 . . . . 0.0 111.308 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -82.58 158.21 23.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.545 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -34.59 69.6 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.383 0.611 . . . . 0.0 109.383 178.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.468 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 37.4 m95 -96.21 129.84 43.42 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 114.985 -1.007 . . . . 0.0 108.703 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.431 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 38.6 m0 -104.11 132.53 50.27 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -177.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.4 ' HB2' ' CE1' ' A' ' 50' ' ' TYR . 56.2 ttt180 -90.03 131.06 36.11 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 177.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 31' ' ' LEU . 0.7 OUTLIER -142.5 157.63 19.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.41 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -123.59 141.85 51.61 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.707 -179.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.412 ' HB2' ' CD2' ' A' ' 21' ' ' LEU . 51.7 t30 -113.15 162.45 15.95 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.016 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.03 -18.91 15.85 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.882 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.71 5.27 11.56 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 67.39 26.05 8.49 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-O 120.852 0.358 . . . . 0.0 111.065 -179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -115.25 125.81 53.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.812 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.3 p -116.81 151.44 36.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.878 0.371 . . . . 0.0 111.032 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.513 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.25 168.38 38.63 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.197 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.4 ' CE1' ' HB2' ' A' ' 40' ' ' ARG . 96.7 m-85 -102.37 102.65 13.01 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.3 m -120.08 122.99 28.59 Favored Pre-proline 0 C--N 1.325 -0.479 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.729 178.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.468 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 84.2 Cg_endo -80.62 29.28 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.25 1.967 . . . . 0.0 112.333 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.66 91.89 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.3 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -68.96 -12.7 61.9 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.059 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.606 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 99.1 m-85 -63.8 -13.79 47.31 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.424 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -113.39 142.4 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-O 121.023 0.44 . . . . 0.0 110.579 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -140.61 157.87 44.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.522 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -69.67 137.74 52.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.9 0.381 . . . . 0.0 110.804 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.4 tttt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.802 -179.78 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.7 t . . . . . 0 N--CA 1.456 -0.151 0 CA-C-O 120.899 0.381 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.5 mt -104.28 116.26 47.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.911 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.421 ' HA ' ' HA ' ' A' ' 58' ' ' ARG . 26.4 m -130.83 163.07 37.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.983 0.42 . . . . 0.0 111.653 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.9 mt -123.65 133.49 69.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.019 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.33 137.01 36.51 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.675 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -102.74 7.45 39.66 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.66 ' CE3' ' HB2' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -163.06 151.18 13.78 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.805 0.336 . . . . 0.0 110.506 178.726 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.409 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 43.3 t0 -79.11 113.68 17.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.031 0.444 . . . . 0.0 111.91 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.469 ' HB2' ' CE2' ' A' ' 11' ' ' TRP . 56.4 t80 -127.57 145.79 50.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.16 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.9 t -105.75 135.22 47.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.373 178.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.432 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -52.75 139.24 27.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.476 . . . . 0.0 112.025 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -64.52 -31.34 72.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.071 0.463 . . . . 0.0 109.817 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -136.73 165.29 26.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.614 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -62.91 -27.89 69.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.861 0.362 . . . . 0.0 110.97 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -68.05 -26.21 65.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.14 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.48 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 0.3 OUTLIER -89.08 176.92 6.79 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.7 mp -128.01 141.55 51.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.999 0.428 . . . . 0.0 111.275 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.0 p-10 -79.17 157.81 27.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.36 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 44.5 pt -127.93 155.48 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.028 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 12' ' ' ASP . 95.4 mttt -111.25 172.45 6.87 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.845 0.355 . . . . 0.0 111.049 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 19.5 pttp -68.01 -12.96 61.77 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -178.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -151.97 29.38 0.58 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.477 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.445 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 59.2 tt0 -98.77 142.06 30.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.84 0.352 . . . . 0.0 110.961 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.5 mtm-85 -92.3 121.59 33.95 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.404 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.445 ' CD2' ' HG2' ' A' ' 27' ' ' GLU . 0.6 OUTLIER -116.09 149.02 39.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.713 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -100.42 107.25 18.95 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.964 0.411 . . . . 0.0 110.743 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.436 HD23 ' CE3' ' A' ' 39' ' ' TRP . 0.1 OUTLIER -86.48 152.02 23.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.309 0.576 . . . . 0.0 112.444 -178.651 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 mp -114.0 -22.38 10.1 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.395 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -163.05 120.61 1.94 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.822 0.344 . . . . 0.0 110.815 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.415 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 30.1 p-10 -117.26 19.38 14.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.1 t -81.57 -34.99 30.71 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.741 0.305 . . . . 0.0 111.368 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.4 mmtm -86.87 160.9 18.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.925 0.393 . . . . 0.0 111.624 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 28.8 m -57.09 -33.98 67.85 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 121.352 0.596 . . . . 0.0 109.654 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.436 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 17.5 m95 -99.31 126.38 45.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.436 ' CE3' HD23 ' A' ' 31' ' ' LEU . 37.7 m0 -99.1 132.06 44.68 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.42 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 35.1 ttt180 -88.02 125.78 34.73 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.438 HG23 ' HB3' ' A' ' 29' ' ' LEU . 2.8 p -136.9 162.12 34.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -177.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -130.38 148.44 52.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.15 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -117.0 171.52 7.86 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.135 0.493 . . . . 0.0 112.034 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.2 -18.21 60.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.869 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.81 6.47 10.91 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 67.63 24.1 8.59 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 120.899 0.381 . . . . 0.0 111.14 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -111.03 128.37 55.84 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.861 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 16.5 p -113.66 159.11 20.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.513 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.48 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -175.1 176.75 47.21 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.18 -1.009 . . . . 0.0 113.347 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.42 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 65.2 m-85 -115.99 110.51 19.04 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -122.99 127.68 25.61 Favored Pre-proline 0 CA--C 1.532 0.251 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.618 178.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.436 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 76.7 Cg_endo -76.43 58.6 5.84 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.114 1.876 . . . . 0.0 111.765 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.3 p -66.97 94.36 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -60.42 -60.55 3.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.05 0.452 . . . . 0.0 109.951 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.66 ' HB2' ' CE3' ' A' ' 11' ' ' TRP . 19.5 m-85 -84.35 97.39 9.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 122.582 1.182 . . . . 0.0 113.431 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.426 HG13 ' CZ3' ' A' ' 39' ' ' TRP . 7.1 p -155.45 140.84 10.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.698 177.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -121.43 134.7 55.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.832 0.349 . . . . 0.0 111.679 -178.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 67.9 ttp85 -78.56 133.42 37.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.867 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.1 mttm . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.007 179.99 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.3 t . . . . . 0 N--CA 1.455 -0.187 0 N-CA-C 110.482 -0.192 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 8.2 mt -106.14 116.71 50.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.766 0.317 . . . . 0.0 111.297 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.8 m -131.33 161.21 41.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.215 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.9 mt -122.41 126.3 73.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.78 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.77 144.94 41.13 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.941 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -110.14 -25.68 10.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.335 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.474 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 8.3 m-90 -133.36 137.63 45.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -61.98 122.05 14.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.621 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.425 ' CD1' ' HB2' ' A' ' 53' ' ' SER . 53.2 t80 -127.09 137.35 53.0 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.648 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.7 m -105.94 137.67 43.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.553 179.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.44 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -53.4 142.58 21.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.218 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -88.24 -8.31 55.46 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.272 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -149.12 167.54 25.65 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.646 0.26 . . . . 0.0 110.508 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -68.14 -29.27 68.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.335 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -77.22 -11.33 59.81 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.863 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.457 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -89.69 179.26 6.06 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 44.0 tp -121.7 134.63 54.96 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.026 0.441 . . . . 0.0 111.71 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -77.11 144.47 38.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.853 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 23.1 pt -131.83 164.66 34.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.109 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -113.13 -177.03 3.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.952 0.406 . . . . 0.0 111.284 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -64.91 -51.49 61.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.586 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -109.83 -5.6 15.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -57.05 144.63 33.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.813 0.34 . . . . 0.0 111.25 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.8 mtm180 -97.63 124.35 41.88 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.63 179.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.475 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 1.8 mm? -111.59 147.13 36.12 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.895 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.2 m-90 -104.33 104.24 14.1 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.144 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.923 ' HG ' ' HD2' ' A' ' 34' ' ' ASP . 0.5 OUTLIER -72.23 147.63 46.3 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.3 0.572 . . . . 0.0 112.259 -179.057 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.2 mp -109.82 -26.68 9.68 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.976 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.66 ' HD2' ' HB2' ' A' ' 35' ' ' SER . 58.4 t0 -160.99 118.16 2.33 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.808 0.337 . . . . 0.0 111.257 -179.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.923 ' HD2' ' HG ' ' A' ' 31' ' ' LEU . 97.0 m-20 -105.61 3.62 29.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.159 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.66 ' HB2' ' HD2' ' A' ' 33' ' ' ASP . 57.7 m -68.57 -35.36 77.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.708 0.289 . . . . 0.0 111.721 -179.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -85.68 156.48 20.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.257 0.551 . . . . 0.0 112.264 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 58.6 m -57.72 -31.8 66.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.188 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.461 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 7.4 m0 -100.26 132.99 45.32 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.417 ' HB3' ' CD1' ' A' ' 31' ' ' LEU . 23.5 m0 -100.69 128.97 46.55 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -176.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.414 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 72.6 ttt180 -87.94 122.82 32.01 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.084 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -138.45 151.09 24.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 120.475 -0.49 . . . . 0.0 112.219 -177.835 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.484 ' CB ' ' HB ' ' A' ' 48' ' ' THR . 24.4 ttp-105 -121.92 146.72 46.85 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.3 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -116.05 164.6 14.22 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.363 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.38 -18.26 16.72 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.867 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.89 4.78 11.11 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.3 t30 72.64 21.59 3.48 Favored 'General case' 0 C--N 1.339 0.116 0 CA-C-O 120.859 0.361 . . . . 0.0 111.302 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -114.8 130.49 56.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.905 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.484 ' HB ' ' CB ' ' A' ' 42' ' ' ARG . 12.2 t -141.34 143.17 33.87 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.778 -179.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.457 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.47 178.64 39.64 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.371 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.414 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.4 m-85 -93.38 113.17 25.28 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.632 0.253 . . . . 0.0 111.512 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.439 ' C ' ' H ' ' A' ' 53' ' ' SER . 4.6 m -127.46 120.94 22.21 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.846 -0.161 . . . . 0.0 111.263 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.461 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 6.3 Cg_exo -72.33 30.92 0.27 Allowed 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.421 2.081 . . . . 0.0 112.091 177.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.439 ' H ' ' C ' ' A' ' 51' ' ' VAL . 8.4 t -66.0 85.51 0.09 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 120.897 0.379 . . . . 0.0 111.135 -179.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 p30 -69.09 -9.97 55.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.422 178.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.474 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 80.9 m-85 -65.2 -10.63 33.03 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.6 p -115.03 141.48 31.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.909 0.385 . . . . 0.0 110.735 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -137.73 150.4 47.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.725 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -69.53 140.5 53.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.802 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 93.2 mttt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.243 -0.884 . . . . 0.0 111.051 179.968 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.3 t . . . . . 0 N--CA 1.452 -0.325 0 CA-C-O 120.761 0.315 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.1 mt -114.06 118.38 58.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.117 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.443 ' CG1' ' HG2' ' A' ' 58' ' ' ARG . 32.9 m -131.39 162.53 39.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 121.048 0.452 . . . . 0.0 111.623 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.5 mt -120.02 123.6 71.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.503 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' A' ' 24' ' ' LYS . . . -75.5 126.5 31.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.202 -179.437 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -96.47 -10.35 27.65 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.336 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.604 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.6 m-90 -145.12 143.14 30.22 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.792 0.329 . . . . 0.0 110.577 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -67.8 125.51 26.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.096 0.474 . . . . 0.0 111.62 -178.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.448 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 58.2 t80 -127.8 138.12 52.62 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.844 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.7 t -102.74 140.28 37.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.913 0.387 . . . . 0.0 110.714 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.463 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -61.45 136.24 57.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.474 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -84.39 -3.58 58.39 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.085 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.463 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 92.8 mt-30 -145.47 171.65 14.33 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.586 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -76.44 -29.84 57.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.935 0.398 . . . . 0.0 111.283 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -75.99 -12.65 60.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.937 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.535 ' HB3' HG12 ' A' ' 51' ' ' VAL . 0.5 OUTLIER -88.74 178.02 6.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.933 0.397 . . . . 0.0 110.726 -179.697 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.511 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.5 mp -124.88 139.52 53.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.77 -178.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -78.6 146.41 34.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.354 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.448 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 45.8 pt -129.84 161.87 38.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.473 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.53 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 99.8 mttt -114.72 166.32 11.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.768 0.318 . . . . 0.0 111.025 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.46 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 21.0 pttp -63.75 -11.32 25.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -138.45 25.95 2.62 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.289 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.445 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 83.9 tt0 -99.57 138.01 37.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.854 0.359 . . . . 0.0 110.903 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -94.1 120.67 34.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.124 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.497 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -115.21 150.06 36.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.04 -179.351 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.0 m-90 -103.43 107.15 17.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.172 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.453 ' HA ' HG22 ' A' ' 41' ' ' VAL . 89.3 mt -76.69 149.15 36.44 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.051 0.453 . . . . 0.0 111.561 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.0 mp -113.97 -28.63 7.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.036 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -160.99 118.88 2.4 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.552 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 31.3 p-10 -110.87 2.8 18.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.128 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.0 m -65.06 -36.82 85.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.828 0.347 . . . . 0.0 111.342 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -83.63 158.75 21.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.083 0.468 . . . . 0.0 111.809 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.7 m -57.44 -34.78 69.32 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.552 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 61.3 m95 -97.64 131.61 44.06 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 177.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.469 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 40.5 m0 -103.94 133.79 48.31 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -177.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.423 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 37.4 ttt180 -88.58 130.1 35.33 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.525 ' HA ' HD13 ' A' ' 32' ' ' LEU . 0.7 OUTLIER -141.04 155.52 21.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 120.915 0.388 . . . . 0.0 111.589 -178.702 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -120.42 145.58 47.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.605 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -113.04 162.56 15.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.703 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.16 -21.33 46.7 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.879 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.34 5.23 10.96 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.857 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.0 t30 72.81 24.68 2.63 Favored 'General case' 0 N--CA 1.46 0.071 0 CA-C-O 120.829 0.347 . . . . 0.0 110.895 -179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.408 ' CB ' HD22 ' A' ' 21' ' ' LEU . 82.5 mtm180 -108.92 136.89 47.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.434 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 74.8 p -124.81 152.7 43.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.729 0.299 . . . . 0.0 110.905 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -174.23 179.87 45.3 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.56 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 95.3 m-85 -110.11 113.54 26.32 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.808 0.304 . . . . 0.0 111.618 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.535 HG12 ' HB3' ' A' ' 20' ' ' GLU . 29.4 m -131.21 112.02 15.59 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.587 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.552 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 74.0 Cg_endo -74.73 45.24 1.25 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.18 1.92 . . . . 0.0 111.855 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.429 ' HB3' ' CD1' ' A' ' 13' ' ' TYR . 1.4 p -69.61 73.63 0.38 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.038 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -53.57 -19.18 3.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.935 0.398 . . . . 0.0 110.93 178.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.604 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 77.5 m-85 -61.11 -12.83 13.66 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.221 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.416 ' CG2' ' HA ' ' A' ' 9' ' ' ALA . 11.9 p -110.36 146.15 15.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-O 120.808 0.337 . . . . 0.0 110.943 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.402 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 85.5 tt0 -142.21 164.17 30.88 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.544 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.443 ' HG2' ' CG1' ' A' ' 7' ' ' VAL . 18.8 mtp180 -68.69 139.28 55.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.528 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.6 tttp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.343 -0.836 . . . . 0.0 110.864 179.938 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 31' ' ' LEU . 64.1 t . . . . . 0 CA--C 1.531 0.244 0 CA-C-O 120.726 0.298 . . . . 0.0 110.382 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.3 mm -100.41 110.97 28.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.807 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.6 m -128.49 155.91 40.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.767 0.318 . . . . 0.0 111.348 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 30.6 mm -121.29 126.98 75.68 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.874 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.96 143.14 45.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.496 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -112.42 -24.34 9.8 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.753 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.578 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.3 m-90 -137.1 136.7 38.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.045 0.45 . . . . 0.0 110.552 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -59.74 120.8 10.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.394 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.424 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 49.3 t80 -127.22 138.39 53.1 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.144 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 86.6 m -107.06 139.64 41.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.657 179.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.429 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.22 135.54 56.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.713 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -87.75 0.32 55.9 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.542 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.457 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 95.8 mt-30 -147.11 167.23 24.63 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -75.05 -20.28 59.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.577 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -88.47 -8.19 55.32 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.457 ' CG ' ' HB2' ' A' ' 17' ' ' GLN . 0.7 OUTLIER -88.54 177.53 6.76 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.658 -179.757 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.422 ' H ' HG11 ' A' ' 51' ' ' VAL . 38.6 tp -119.44 128.66 54.23 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -70.4 141.69 52.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.9 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.402 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 35.9 pt -130.65 162.59 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.253 179.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.411 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 88.3 mttt -110.95 -177.27 3.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.901 0.381 . . . . 0.0 110.767 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HG3' ' HA ' ' A' ' 11' ' ' TRP . 27.6 ttpp -65.3 -48.76 72.01 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.626 -178.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -114.61 -0.25 13.71 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.411 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 66.3 tt0 -57.62 144.11 38.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.105 0.479 . . . . 0.0 111.175 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -91.49 121.67 33.39 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.467 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.637 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.7 mm? -115.28 140.65 48.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.344 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -100.89 105.26 16.51 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.793 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.671 HD12 ' HB3' ' A' ' 39' ' ' TRP . 5.6 tp -84.1 151.34 24.99 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.401 HD11 ' HA ' ' A' ' 41' ' ' VAL . 3.6 mp -107.92 -19.32 13.56 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.757 178.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -168.82 125.12 0.95 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.787 0.327 . . . . 0.0 111.326 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -115.58 2.18 13.73 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.682 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.2 m -64.13 -38.33 90.65 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.791 0.329 . . . . 0.0 111.623 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -82.9 159.01 22.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.002 0.429 . . . . 0.0 111.746 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.8 m -58.94 -35.58 73.36 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.47 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 22.6 m95 -94.59 127.67 40.69 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.671 ' HB3' HD12 ' A' ' 31' ' ' LEU . 41.5 m0 -102.06 134.45 45.27 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -177.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.455 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 53.6 ttt180 -92.38 125.81 37.19 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.931 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.637 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -139.2 161.79 28.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -178.514 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -125.81 147.58 49.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.042 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.416 ' HB3' ' CD2' ' A' ' 21' ' ' LEU . 47.3 p-10 -118.6 172.25 7.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.012 0.434 . . . . 0.0 111.762 -179.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.37 -23.43 65.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.541 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.36 4.97 9.57 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 68.98 25.68 5.89 Favored 'General case' 0 N--CA 1.457 -0.093 0 CA-C-O 120.815 0.34 . . . . 0.0 111.012 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 55.3 mtp180 -111.09 132.46 54.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.692 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 80.6 p -123.49 148.28 46.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.923 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.453 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.2 168.69 40.58 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.39 -0.909 . . . . 0.0 113.142 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.455 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 96.9 m-85 -101.14 103.91 14.98 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.422 HG11 ' H ' ' A' ' 21' ' ' LEU . 4.7 m -117.4 119.93 33.91 Favored Pre-proline 0 C--N 1.33 -0.26 0 C-N-CA 121.214 -0.194 . . . . 0.0 111.385 178.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.47 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 72.6 Cg_endo -74.84 41.63 0.75 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.356 2.038 . . . . 0.0 111.6 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.435 ' O ' HG12 ' A' ' 56' ' ' VAL . 80.2 p -71.07 89.93 0.83 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.586 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -66.44 -13.23 60.48 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.589 -0.445 . . . . 0.0 110.166 178.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.578 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.5 m-85 -64.11 -12.96 44.29 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.435 HG12 ' O ' ' A' ' 53' ' ' SER . 9.4 p -114.6 140.9 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 121.129 0.49 . . . . 0.0 110.848 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -133.78 163.25 29.89 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.418 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 71.6 ttt-85 -80.21 135.74 36.33 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.47 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.684 179.786 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.421 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.7 t . . . . . 0 CA--C 1.531 0.214 0 CA-C-O 120.796 0.331 . . . . 0.0 110.402 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -98.67 112.32 30.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.352 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 35.4 m -131.58 162.28 39.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.045 0.45 . . . . 0.0 111.835 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.42 HD13 HG21 ' A' ' 8' ' ' ILE . 33.5 mt -120.18 124.58 72.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.851 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.61 120.43 20.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.061 0.458 . . . . 0.0 111.481 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -92.96 -9.49 39.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.842 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.609 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.3 m-90 -141.86 142.24 33.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.87 0.366 . . . . 0.0 110.85 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -72.43 123.15 22.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.462 -179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.425 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 57.8 t80 -127.53 137.77 52.72 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.53 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.01 135.13 41.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.421 ' CB ' ' HG3' ' A' ' 20' ' ' GLU . . . -61.91 136.84 58.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.032 0.444 . . . . 0.0 111.795 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -86.53 0.14 54.91 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.313 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.45 ' HB2' ' HG2' ' A' ' 20' ' ' GLU . 96.7 mt-30 -153.69 162.0 41.64 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.914 0.387 . . . . 0.0 110.992 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -64.75 -40.21 94.93 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.242 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -61.01 -31.3 70.92 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.918 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.657 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 6.1 pt-20 -86.47 175.5 8.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.12 -179.417 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.455 HD22 ' CB ' ' A' ' 47' ' ' ARG . 10.6 mp -128.88 158.88 37.52 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -176.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -86.97 149.67 24.61 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.884 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 47.6 pt -130.68 161.05 41.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.798 178.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -115.9 166.54 11.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.253 0.549 . . . . 0.0 111.437 -179.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.452 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 54.9 pttt -66.37 -11.24 50.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.781 -179.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -140.54 25.35 2.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.406 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -100.94 140.0 35.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.101 0.477 . . . . 0.0 110.69 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 -91.69 119.57 31.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.824 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.473 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.2 mm? -110.55 143.59 40.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.419 -178.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 29.4 m-90 -98.78 106.01 18.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.985 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.431 ' HA ' HG22 ' A' ' 41' ' ' VAL . 73.0 mt -75.64 148.77 38.48 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.489 0.662 . . . . 0.0 111.823 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.504 ' N ' HD23 ' A' ' 32' ' ' LEU . 3.6 mm? -115.27 -35.52 4.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.896 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.411 ' HD2' ' HB3' ' A' ' 35' ' ' SER . 57.0 t0 -160.68 116.96 2.31 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.753 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -109.99 3.81 20.79 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.411 ' HB3' ' HD2' ' A' ' 33' ' ' ASP . 35.0 t -66.63 -39.24 88.19 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.799 0.333 . . . . 0.0 111.289 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -82.66 159.15 22.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.641 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.0 -34.75 68.46 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 121.417 0.627 . . . . 0.0 109.38 178.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.461 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 63.4 m95 -96.18 130.03 43.34 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.44 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 39.6 m0 -104.4 127.3 52.06 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.44 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 66.8 ttt180 -84.9 126.88 33.86 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.478 ' HA ' HD23 ' A' ' 32' ' ' LEU . 0.8 OUTLIER -134.69 161.92 39.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.102 0.477 . . . . 0.0 111.87 -178.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.402 ' CB ' HG23 ' A' ' 48' ' ' THR . 41.6 ttm180 -123.66 151.31 43.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.891 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.418 ' ND2' HD23 ' A' ' 21' ' ' LEU . 34.0 m-20 -119.68 168.57 10.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.813 0.34 . . . . 0.0 111.246 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.19 67.73 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.382 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.86 4.56 9.52 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.1 t30 72.44 24.06 3.02 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.819 0.343 . . . . 0.0 111.093 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.455 ' CB ' HD22 ' A' ' 21' ' ' LEU . 81.2 mtp180 -106.09 135.5 47.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.402 HG23 ' CB ' ' A' ' 42' ' ' ARG . 77.0 p -124.66 157.58 35.21 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.21 -179.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.657 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -174.02 174.27 46.25 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 120.303 -0.951 . . . . 0.0 113.105 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.44 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.7 m-85 -107.2 97.0 6.82 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -178.54 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.414 ' CG1' ' HB2' ' A' ' 20' ' ' GLU . 0.8 OUTLIER -115.26 116.91 41.66 Favored Pre-proline 0 N--CA 1.469 0.51 0 CA-C-O 119.622 -0.228 . . . . 0.0 111.361 177.839 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.461 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 73.9 Cg_endo -76.63 44.4 1.4 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.243 1.962 . . . . 0.0 111.464 177.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.516 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.8 OUTLIER -70.26 80.08 0.53 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -59.49 -17.28 30.37 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.554 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.609 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 85.7 m-85 -59.82 -12.51 7.57 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.516 HG13 ' O ' ' A' ' 53' ' ' SER . 8.6 p -109.6 143.73 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 120.939 0.399 . . . . 0.0 110.96 179.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 55.6 mp0 -143.38 161.22 38.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.583 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -71.01 140.51 50.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.125 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.4 tttt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.753 179.312 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 30' ' ' TRP . 93.2 t . . . . . 0 C--O 1.223 -0.298 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.406 HG12 ' CD1' ' A' ' 30' ' ' TRP . 41.5 mt -114.49 115.88 50.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.771 0.32 . . . . 0.0 110.847 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.9 m -130.77 159.68 42.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.129 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 16.4 mm -114.93 125.71 72.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.59 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.05 145.17 42.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.802 0.334 . . . . 0.0 110.862 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -112.75 -23.7 10.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.477 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.547 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.8 m-90 -134.21 139.76 46.02 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.975 0.417 . . . . 0.0 110.593 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -66.68 121.22 14.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.282 -178.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.426 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 47.3 t80 -126.25 136.56 52.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.694 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.5 m -103.34 145.56 29.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.841 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.426 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.28 138.92 54.18 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.276 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -84.54 -9.3 58.45 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.975 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.404 ' HB2' ' HG2' ' A' ' 20' ' ' GLU . 74.9 mt-30 -150.75 168.78 23.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.235 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -67.08 -34.0 76.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.893 0.378 . . . . 0.0 111.64 -179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -77.66 -6.03 52.45 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.019 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.689 ' HB3' HG12 ' A' ' 51' ' ' VAL . 0.5 OUTLIER -87.74 179.04 6.57 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.801 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.471 ' O ' HG11 ' A' ' 51' ' ' VAL . 43.7 tp -121.32 119.12 31.27 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -68.32 141.47 55.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.266 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.488 HG21 ' CD1' ' A' ' 29' ' ' LEU . 14.9 pt -128.14 165.52 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.981 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.441 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 60.2 mttt -114.09 -179.12 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.215 0.531 . . . . 0.0 111.057 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.411 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 36.5 ttpt -64.53 -48.14 76.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.804 -178.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -113.09 2.57 15.74 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.441 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 71.3 tt0 -60.53 148.19 38.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.122 0.487 . . . . 0.0 111.363 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -94.54 121.32 35.96 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.946 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.654 ' HB3' HG22 ' A' ' 41' ' ' VAL . 3.6 mm? -114.58 137.79 51.45 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.433 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 6.3 m0 -101.3 106.01 17.15 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.982 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.419 ' O ' ' HB ' ' A' ' 5' ' ' VAL . 81.3 mt -78.58 154.53 30.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.488 0.661 . . . . 0.0 111.94 -179.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.476 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.0 mp -117.09 -29.19 6.01 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.808 179.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -158.98 116.65 2.82 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.203 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.465 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 40.2 p-10 -111.14 10.45 21.91 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.5 t -74.2 -35.24 63.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.878 0.371 . . . . 0.0 111.432 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmtp -84.4 159.62 20.79 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.794 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 87.9 m -59.27 -32.97 70.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.422 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.451 ' CD1' ' N ' ' A' ' 38' ' ' TRP . 2.8 m95 -96.74 130.95 43.89 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.465 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 32.5 m0 -103.36 135.85 44.22 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -177.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.41 ' HG2' HD11 ' A' ' 32' ' ' LEU . 28.3 ttm180 -96.7 127.86 43.09 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.654 HG22 ' HB3' ' A' ' 29' ' ' LEU . 3.8 p -143.55 156.62 16.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.962 -177.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -122.84 143.18 50.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.049 0.452 . . . . 0.0 111.68 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 -107.37 161.67 14.6 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.236 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.98 -24.28 64.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.197 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.67 2.64 11.46 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.357 -0.383 . . . . 0.0 112.032 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.2 t30 73.93 24.38 2.07 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.678 0.275 . . . . 0.0 111.042 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -109.39 129.71 55.53 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.308 -0.406 . . . . 0.0 109.956 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.1 p -125.15 161.58 26.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.694 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 178.6 169.73 39.71 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.997 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -97.49 108.76 21.54 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.788 0.328 . . . . 0.0 111.689 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.689 HG12 ' HB3' ' A' ' 20' ' ' GLU . 9.6 m -132.3 114.17 14.69 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.64 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -70.77 44.5 0.51 Allowed 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 121.858 1.706 . . . . 0.0 111.761 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 85.6 p -70.57 76.91 0.58 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 121.045 0.45 . . . . 0.0 110.506 -179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -60.14 -17.97 44.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.638 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.547 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 83.0 m-85 -58.86 -15.5 12.87 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.5 p -112.95 141.12 29.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-O 121.001 0.429 . . . . 0.0 110.676 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -142.96 162.57 35.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.088 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.5 ttm180 -70.96 140.59 50.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.772 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.965 -179.907 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.445 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.4 t . . . . . 0 C--O 1.225 -0.229 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.4 mt -104.15 112.97 39.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.438 0.161 . . . . 0.0 111.312 -179.805 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 32.1 m -128.15 162.72 33.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 120.794 0.331 . . . . 0.0 111.469 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.3 mm -120.01 120.07 62.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.586 -179.382 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.4 119.65 20.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.745 179.664 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -92.48 -8.37 44.79 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.037 -179.759 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.436 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 7.3 m-90 -142.49 142.4 32.27 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.789 0.328 . . . . 0.0 110.859 -179.594 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -71.56 122.59 20.76 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.046 0.45 . . . . 0.0 110.95 -178.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.43 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 58.4 t80 -127.8 137.08 52.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.943 -179.908 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.6 m -103.77 139.06 39.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.653 179.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.438 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -55.71 136.73 50.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.575 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.556 ' CG ' ' HE2' ' A' ' 20' ' ' GLU . 14.4 pt20 -91.18 1.51 57.04 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.441 178.776 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.492 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 99.3 mt-30 -142.74 166.23 25.23 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.219 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -75.82 -20.9 57.81 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.136 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -90.16 -5.51 56.37 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -179.486 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.556 ' HE2' ' CG ' ' A' ' 16' ' ' GLN . 0.8 OUTLIER -87.25 -179.46 6.42 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.051 0.453 . . . . 0.0 111.499 -179.565 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.446 ' O ' HG13 ' A' ' 51' ' ' VAL . 14.2 tp -124.1 130.67 52.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.526 -178.069 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -72.82 147.54 45.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.467 179.303 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.43 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 37.2 pt -132.2 164.3 35.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.647 179.503 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.474 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 59.9 mttt -118.06 167.09 11.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.158 0.504 . . . . 0.0 110.975 179.808 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.436 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 52.6 pttt -66.45 -11.52 52.41 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.931 -179.575 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -141.78 27.73 1.82 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.965 0.412 . . . . 0.0 110.903 179.542 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.474 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 82.0 tt0 -99.69 140.7 33.5 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.208 0.528 . . . . 0.0 111.04 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.2 mtm180 -89.16 119.28 29.52 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.712 -179.928 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.727 ' HB3' HG22 ' A' ' 41' ' ' VAL . 3.0 mm? -115.23 139.9 49.55 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.806 -178.165 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.411 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 5.5 m-90 -103.83 104.42 14.42 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.308 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.577 HD11 ' HD2' ' A' ' 34' ' ' ASP . 33.6 mt -77.56 142.22 39.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.259 0.552 . . . . 0.0 112.05 -178.932 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -105.02 -26.7 12.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.04 -179.899 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -159.03 115.12 2.62 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.803 0.335 . . . . 0.0 110.788 179.739 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.577 ' HD2' HD11 ' A' ' 31' ' ' LEU . 88.6 m-20 -108.18 4.67 25.06 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.061 -179.746 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.4 p -71.19 -34.32 70.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.967 0.413 . . . . 0.0 111.026 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -83.78 158.14 21.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.716 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 81.3 m -59.32 -33.04 70.64 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.195 178.285 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.447 ' CD1' ' N ' ' A' ' 38' ' ' TRP . 5.5 m95 -98.74 131.7 44.68 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 177.554 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.429 ' CE3' HD11 ' A' ' 31' ' ' LEU . 35.9 m0 -103.87 130.94 51.5 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -177.404 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.44 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 39.6 ttt85 -88.09 136.4 32.99 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 177.601 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.727 HG22 ' HB3' ' A' ' 29' ' ' LEU . 2.4 p -150.36 155.17 7.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.831 -178.879 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -121.4 144.2 48.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.075 -179.709 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.439 ' HB2' ' CD2' ' A' ' 21' ' ' LEU . 43.8 t-20 -110.41 164.45 12.68 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.062 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.13 -25.4 65.45 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.256 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.26 3.72 8.36 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 179.382 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 73.96 24.36 2.06 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 120.749 0.309 . . . . 0.0 110.819 -179.621 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.4 mtm180 -108.05 131.56 54.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.069 179.52 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 30.6 p -126.34 147.86 49.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.144 -179.472 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.447 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.22 167.3 39.77 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.806 179.861 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.44 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.2 m-85 -99.63 106.44 18.39 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 117.082 0.441 . . . . 0.0 112.182 -179.23 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.519 HG11 ' HB3' ' A' ' 20' ' ' GLU . 14.0 m -124.94 114.47 26.54 Favored Pre-proline 0 CA--C 1.534 0.342 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 179.19 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.98 35.4 0.27 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 122.027 1.818 . . . . 0.0 112.211 177.698 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.418 ' H ' ' C ' ' A' ' 51' ' ' VAL . 7.5 t -67.93 81.46 0.21 Allowed 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 120.861 0.362 . . . . 0.0 110.426 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -57.11 -19.12 17.9 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.146 0.498 . . . . 0.0 110.626 178.375 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.419 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 91.8 m-85 -54.58 -16.52 2.47 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.728 179.447 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.6 p -115.69 140.49 37.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 120.958 0.408 . . . . 0.0 111.147 179.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -145.54 161.91 38.67 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.891 -179.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 67.5 ttp85 -72.48 142.15 48.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.902 179.805 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 94.3 mttt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.671 179.443 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.471 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 60.4 t . . . . . 0 N--CA 1.455 -0.217 0 CA-C-O 120.741 0.305 . . . . 0.0 110.733 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.442 HG12 ' HD1' ' A' ' 30' ' ' TRP . 24.6 mt -102.6 120.61 52.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.08 -179.98 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.627 HG12 ' HB3' ' A' ' 58' ' ' ARG . 27.2 m -129.62 164.98 30.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.164 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.495 HG12 ' HG2' ' A' ' 28' ' ' ARG . 26.2 mt -123.14 123.8 68.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.687 179.545 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.9 120.51 21.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.346 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -90.04 -7.21 54.45 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.814 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.536 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 5.3 m-90 -144.48 143.25 30.78 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.819 0.343 . . . . 0.0 111.342 -179.604 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -70.45 121.58 18.03 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.548 179.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.448 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 63.6 t80 -127.66 140.13 52.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.966 0.412 . . . . 0.0 111.397 -179.476 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 75.0 m -102.21 137.97 39.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.683 179.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.459 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.8 139.23 54.5 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.488 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -89.93 -0.01 57.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.299 179.1 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.484 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 94.2 mt-30 -147.23 163.85 35.05 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 179.225 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -70.59 -24.72 62.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 111.814 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -82.91 -15.51 51.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.271 -0.422 . . . . 0.0 112.115 -179.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.484 ' CG ' ' HB2' ' A' ' 17' ' ' GLN . 0.6 OUTLIER -85.88 177.53 7.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.097 0.475 . . . . 0.0 110.431 179.749 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.401 HD12 ' C ' ' A' ' 20' ' ' GLU . 8.2 mp -129.43 142.41 50.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.489 -179.471 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -77.92 155.67 30.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.803 179.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.448 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 50.6 pt -133.55 165.02 33.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.478 179.59 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 40.0 mttp -115.76 165.73 12.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.062 0.458 . . . . 0.0 111.146 -179.652 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.536 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 22.4 pttp -64.97 -14.14 59.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.629 -179.328 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -138.92 25.72 2.51 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.189 179.738 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.484 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 80.8 tt0 -100.77 138.54 37.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.104 0.478 . . . . 0.0 110.967 -179.95 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.495 ' HG2' HG12 ' A' ' 8' ' ' ILE . 82.6 mtm180 -94.1 123.17 37.3 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.927 -179.853 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.555 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 0.5 OUTLIER -115.72 150.2 37.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.889 0.376 . . . . 0.0 111.1 -179.668 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.442 ' HD1' HG12 ' A' ' 6' ' ' ILE . 7.5 m-90 -101.38 111.73 24.04 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.267 179.917 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.471 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 72.0 mt -74.84 148.56 40.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.945 0.402 . . . . 0.0 111.416 -179.794 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.484 HD11 ' HA ' ' A' ' 41' ' ' VAL . 5.4 mp -111.31 -27.22 8.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.67 179.454 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -161.87 118.38 2.09 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.595 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.442 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 35.0 p-10 -110.02 6.76 23.29 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.655 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.0 p -71.87 -35.5 69.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.957 0.408 . . . . 0.0 111.212 -179.715 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -83.63 157.56 22.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.715 -179.491 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.8 m -57.32 -35.52 69.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.199 178.315 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -97.5 128.54 44.34 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.6 177.854 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.442 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 42.2 m0 -99.03 140.23 33.5 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -177.903 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.524 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 47.8 ttt180 -99.56 134.47 42.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.075 -0.966 . . . . 0.0 108.778 178.081 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.555 ' CG2' ' HB3' ' A' ' 29' ' ' LEU . 0.5 OUTLIER -136.53 161.92 36.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.924 0.392 . . . . 0.0 111.8 -178.455 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.9 ttp-105 -126.5 143.06 51.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.091 179.658 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 44.4 p-10 -110.81 169.39 8.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.55 -179.452 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.85 -22.57 64.36 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.355 179.827 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.73 5.79 3.72 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.793 179.214 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 67.58 22.65 9.09 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 121.015 0.436 . . . . 0.0 110.957 -179.264 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -109.43 137.97 46.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.306 179.335 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 52.2 p -121.52 161.56 22.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.752 0.311 . . . . 0.0 110.988 -179.803 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.33 174.77 47.24 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.692 -179.876 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.524 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 95.6 m-85 -107.7 111.23 23.33 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.783 0.325 . . . . 0.0 111.386 -179.684 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.443 ' C ' ' H ' ' A' ' 53' ' ' SER . 21.5 t -122.41 109.54 32.89 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.189 179.609 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.05 32.64 0.27 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.214 1.943 . . . . 0.0 112.313 178.876 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.443 ' H ' ' C ' ' A' ' 51' ' ' VAL . 8.8 t -72.93 87.01 1.31 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 120.948 0.404 . . . . 0.0 111.065 -179.675 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -67.14 -8.66 32.67 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.757 178.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -63.34 -10.08 14.86 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.856 179.418 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.6 p -118.05 142.11 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-O 120.895 0.378 . . . . 0.0 110.801 179.878 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -147.04 159.56 43.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.824 -179.712 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.627 ' HB3' HG12 ' A' ' 7' ' ' VAL . 29.4 ptt180 -71.43 144.44 49.75 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.798 0.332 . . . . 0.0 111.18 179.836 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.9 tttt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.19 -0.909 . . . . 0.0 110.716 179.341 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.447 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 58.4 t . . . . . 0 N--CA 1.453 -0.277 0 CA-C-O 120.678 0.275 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.1 mt -115.35 119.28 61.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.167 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.459 ' CG1' ' HG2' ' A' ' 58' ' ' ARG . 28.0 m -132.16 161.13 41.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.08 179.477 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.465 HD12 ' HB3' ' A' ' 28' ' ' ARG . 28.0 mm -116.55 127.85 74.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.435 179.534 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.23 148.18 39.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -179.669 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 63.6 mttp -113.6 -16.83 12.29 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.671 179.951 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.51 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 16.1 m-90 -142.42 137.97 30.75 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.102 0.477 . . . . 0.0 110.655 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -63.62 123.74 19.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.035 -178.863 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.469 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 55.5 t80 -127.89 139.55 52.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.63 -179.613 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.15 138.62 40.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.191 179.212 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.457 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -55.27 127.42 29.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.445 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.41 ' OE1' ' CZ3' ' A' ' 38' ' ' TRP . 96.0 mt-30 -62.36 -35.02 77.82 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.148 0.499 . . . . 0.0 110.367 179.678 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -129.3 162.0 28.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.097 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -61.89 -34.66 76.44 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.014 0.435 . . . . 0.0 111.157 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -63.11 -24.75 68.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.444 -179.823 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.457 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 1.3 mm-40 -81.04 -179.58 7.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.117 0.485 . . . . 0.0 110.131 179.621 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 tp -119.42 144.58 46.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.517 -178.524 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -85.31 143.57 28.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.761 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.469 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 38.8 pt -131.0 162.92 38.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.651 179.539 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 72.0 mmtt -110.97 176.2 5.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.163 0.506 . . . . 0.0 111.064 179.691 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.496 ' HG3' ' HA ' ' A' ' 11' ' ' TRP . 28.6 ttpp -63.08 -45.91 89.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.841 -178.827 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -109.76 -0.25 18.55 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.463 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 78.5 tt0 -64.63 145.3 56.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.423 0.63 . . . . 0.0 111.19 -179.405 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.465 ' HB3' HD12 ' A' ' 8' ' ' ILE . 22.4 ptt-85 -99.26 121.96 41.77 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.533 -179.992 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.763 ' HB3' HG23 ' A' ' 41' ' ' VAL . 2.0 mm? -113.38 146.55 39.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.555 -179.099 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -102.11 108.35 19.73 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.268 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.447 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 83.8 mt -75.04 150.75 38.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.033 0.444 . . . . 0.0 111.638 -179.517 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.503 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -112.63 -28.43 7.82 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.664 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -160.99 118.47 2.36 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.853 0.359 . . . . 0.0 110.768 179.763 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.457 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 32.7 p-10 -106.84 1.23 24.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.282 -179.765 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.4 m -63.9 -37.36 87.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.889 0.376 . . . . 0.0 111.687 -179.435 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -81.91 158.67 23.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.148 -179.133 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.7 m -58.96 -37.01 75.78 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 177.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.41 ' CZ3' ' OE1' ' A' ' 16' ' ' GLN . 26.7 m95 -96.37 129.35 43.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.51 177.697 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.457 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 36.2 m0 -99.21 138.78 35.82 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.825 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.445 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 69.7 ttt180 -97.04 132.77 42.51 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.188 178.378 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.763 HG23 ' HB3' ' A' ' 29' ' ' LEU . 2.1 p -140.83 155.91 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.143 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.4 ttm180 -125.23 140.16 53.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.69 -179.282 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 47.6 p-10 -108.92 172.13 7.03 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.174 0.512 . . . . 0.0 111.749 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.2 -24.34 67.16 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.168 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.36 3.47 5.88 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 179.472 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.6 t30 69.57 24.96 5.42 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 120.861 0.362 . . . . 0.0 111.28 -179.89 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -112.98 136.07 53.06 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.087 179.133 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.4 p -125.0 156.76 37.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.042 0.449 . . . . 0.0 111.704 -179.026 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -173.26 173.16 45.61 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.458 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.445 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.7 m-85 -102.66 110.12 21.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.882 0.372 . . . . 0.0 110.462 179.836 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.1 t -121.98 110.14 33.27 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.658 -179.737 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -73.99 35.87 0.39 Allowed 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 121.824 1.682 . . . . 0.0 112.46 177.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.1 t -68.54 87.52 0.32 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.826 0.345 . . . . 0.0 111.074 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -59.83 -18.33 43.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.188 0.518 . . . . 0.0 110.062 177.54 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.51 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.9 m-85 -56.0 -17.05 5.78 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.657 179.589 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.1 p -113.07 142.98 23.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 CA-C-O 121.047 0.451 . . . . 0.0 110.86 -179.821 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -141.86 159.94 41.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.766 -179.649 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.459 ' HG2' ' CG1' ' A' ' 7' ' ' VAL . 78.8 mtp180 -69.59 141.62 53.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.835 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.721 179.58 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.443 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.8 t . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.728 0.299 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.6 mm -98.42 117.38 43.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.994 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.1 m -135.12 162.3 38.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.145 0.498 . . . . 0.0 112.05 -179.699 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.4 mt -122.51 124.08 69.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.798 -179.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.401 ' HA ' ' CG2' ' A' ' 56' ' ' VAL . . . -76.59 119.94 21.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.073 0.463 . . . . 0.0 111.702 -179.491 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -91.56 -7.68 49.56 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.169 -179.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.679 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 15.9 m-90 -142.41 143.74 32.8 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.919 0.39 . . . . 0.0 110.536 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.7 p-10 -74.16 121.54 21.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.364 -179.13 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.428 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 60.9 t80 -127.91 138.22 52.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.67 179.914 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.3 t -101.41 142.57 32.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.768 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.462 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -58.03 132.42 53.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.836 -179.717 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.408 ' OE1' ' CH2' ' A' ' 38' ' ' TRP . 92.8 mt-30 -66.75 -30.38 70.58 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 121.131 0.491 . . . . 0.0 110.244 179.165 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -132.66 161.42 33.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.125 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -62.29 -31.95 72.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.895 0.379 . . . . 0.0 111.9 -179.163 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -71.17 -15.39 62.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.72 -179.744 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.682 ' HB3' HG11 ' A' ' 51' ' ' VAL . 2.4 mm-40 -84.79 -178.97 7.0 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.356 -179.388 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.459 ' CD2' ' HB2' ' A' ' 43' ' ' ASN . 13.1 tp -125.79 123.87 39.73 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -177.884 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -68.43 152.67 45.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.716 179.401 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.428 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 45.5 pt -133.98 162.13 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.098 179.249 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -117.11 164.84 14.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.285 0.564 . . . . 0.0 111.22 -179.934 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 52.0 pttt -64.54 -13.49 52.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.954 -179.591 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -140.72 24.77 2.21 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.331 179.643 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -102.25 135.64 43.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.158 0.504 . . . . 0.0 110.871 179.845 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.0 mtm-85 -89.49 120.71 31.05 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.69 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.489 ' HB3' HG22 ' A' ' 41' ' ' VAL . 2.8 mm? -110.95 145.89 37.57 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.131 -177.792 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 27.1 m-90 -99.73 105.05 16.81 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.611 0.243 . . . . 0.0 111.216 179.173 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.443 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 96.1 mt -76.22 148.63 37.53 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.116 0.484 . . . . 0.0 111.2 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.502 HD11 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -112.77 -32.38 6.43 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.624 179.902 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -156.99 114.72 3.17 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.396 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.437 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 29.9 p-10 -109.27 1.79 20.4 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -179.035 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.4 m -65.02 -36.02 83.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.876 0.37 . . . . 0.0 111.584 -179.626 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -82.42 158.33 23.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.509 0.671 . . . . 0.0 112.488 -179.042 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 20.1 p -55.58 -39.42 70.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.354 178.112 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.408 ' CH2' ' OE1' ' A' ' 16' ' ' GLN . 28.8 m95 -93.26 133.28 36.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.759 -1.11 . . . . 0.0 108.285 177.24 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.437 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 33.9 m0 -105.48 131.35 53.01 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -177.871 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 29.6 ttp180 -91.06 133.11 35.58 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.753 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.502 ' HA ' HD11 ' A' ' 32' ' ' LEU . 2.7 p -143.61 159.72 16.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 C-N-CA 120.268 -0.573 . . . . 0.0 112.257 -177.554 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -119.57 152.65 36.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.456 -179.08 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.459 ' HB2' ' CD2' ' A' ' 21' ' ' LEU . 58.4 t30 -120.46 159.73 24.55 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.749 0.309 . . . . 0.0 111.058 179.418 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.56 -21.34 52.47 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.849 178.765 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.45 5.7 14.37 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.171 179.19 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.8 m120 70.07 22.28 5.75 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 122.592 0.357 . . . . 0.0 111.311 -179.249 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 82.7 mtt85 -109.16 127.31 54.09 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.055 178.808 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.4 p -123.12 151.06 42.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.148 -179.61 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.421 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.57 174.9 40.63 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.561 179.856 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -105.16 110.88 23.43 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 117.0 0.4 . . . . 0.0 111.93 -179.436 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.682 HG11 ' HB3' ' A' ' 20' ' ' GLU . 16.0 m -132.46 115.45 14.85 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.12 178.661 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.35 43.58 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.773 1.649 . . . . 0.0 111.966 178.878 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.7 m -63.76 97.07 0.14 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.019 0.438 . . . . 0.0 110.462 -179.78 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -72.24 -15.67 61.93 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.498 179.093 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.679 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 89.2 m-85 -69.1 -10.47 57.79 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.452 -179.536 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.401 ' CG2' ' HA ' ' A' ' 9' ' ' ALA . 9.2 p -113.24 139.73 37.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 O-C-N 121.732 -0.605 . . . . 0.0 110.781 179.358 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -144.94 160.05 41.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.357 -179.81 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.9 ptt-85 -70.13 137.2 50.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.266 -179.475 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 61.9 tttm . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.744 179.81 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 56.0 t . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 120.737 0.303 . . . . 0.0 110.511 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.8 mt -104.73 121.01 56.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.825 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.535 HG11 ' HB3' ' A' ' 58' ' ' ARG . 25.5 m -132.72 161.07 42.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.97 0.414 . . . . 0.0 111.781 -179.798 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.525 HG12 ' HG2' ' A' ' 28' ' ' ARG . 16.9 mt -120.99 128.05 76.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.005 -179.918 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.401 ' N ' HG23 ' A' ' 56' ' ' VAL . . . -77.64 127.26 32.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.004 -179.988 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -93.74 -13.31 27.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.449 179.596 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.455 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 7.3 m-90 -140.58 154.12 46.37 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-O 120.999 0.428 . . . . 0.0 111.311 -179.699 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.413 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 11.4 t70 -76.58 123.82 26.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.525 -179.493 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.453 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 63.3 t80 -127.97 140.36 52.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.157 -179.776 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.1 m -104.19 138.02 41.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.703 179.571 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.433 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -59.0 138.03 57.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.784 -179.814 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -86.77 -0.27 56.06 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.455 178.703 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.513 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 78.1 mt-30 -147.75 167.42 24.73 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.135 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -73.67 -29.97 62.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.007 0.432 . . . . 0.0 111.361 -179.638 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -76.25 -14.94 60.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.208 -179.393 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.649 ' HB3' HG11 ' A' ' 51' ' ' VAL . 0.6 OUTLIER -85.79 178.08 7.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.915 0.388 . . . . 0.0 111.04 -179.467 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.462 ' O ' HG13 ' A' ' 51' ' ' VAL . 7.6 mp -124.85 141.64 51.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.3 0.572 . . . . 0.0 111.481 -178.19 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -80.77 147.78 30.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.746 179.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.453 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 47.0 pt -129.2 164.88 30.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.222 179.228 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.409 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 68.8 mttm -116.5 176.78 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.18 0.514 . . . . 0.0 112.037 -179.095 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.455 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 28.1 mttt -61.7 -30.17 70.57 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.838 -179.871 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -133.78 53.34 2.01 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.064 0.459 . . . . 0.0 110.903 -179.483 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.45 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 80.2 tt0 -117.08 137.69 52.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.038 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.525 ' HG2' HG12 ' A' ' 8' ' ' ILE . 94.0 mtm-85 -96.77 122.79 40.11 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.197 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.578 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -117.04 147.88 41.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.081 -179.873 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.2 m-90 -99.99 106.53 18.33 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.209 179.762 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.485 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 80.0 mt -76.24 146.39 39.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.094 0.473 . . . . 0.0 111.633 -179.401 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.49 HD11 ' HG2' ' A' ' 40' ' ' ARG . 5.3 mp -111.69 -30.51 7.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.753 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.478 ' HD2' ' HB2' ' A' ' 35' ' ' SER . 51.8 t0 -161.01 120.13 2.57 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.474 179.548 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.456 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.1 p-10 -110.84 1.54 17.74 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -179.46 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.478 ' HB2' ' HD2' ' A' ' 33' ' ' ASP . 70.7 m -63.41 -39.04 93.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.741 0.305 . . . . 0.0 111.532 -179.576 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -81.72 158.82 24.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.007 0.432 . . . . 0.0 111.656 -179.511 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.9 -35.01 68.49 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.077 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.582 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 61.2 m95 -96.92 129.38 44.38 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.453 177.668 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.484 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 39.4 m0 -104.17 132.71 50.14 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -177.662 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.553 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 65.5 ttt180 -87.92 134.12 33.78 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.592 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.578 HG23 ' HB3' ' A' ' 29' ' ' LEU . 1.2 p -139.73 161.22 27.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.761 -178.796 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -125.54 142.01 51.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.837 -179.715 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -111.88 165.63 11.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.471 -179.523 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.69 -27.67 65.04 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.448 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -72.8 5.11 3.42 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.886 179.191 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.6 m120 69.23 25.68 5.61 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.002 0.43 . . . . 0.0 111.058 -179.659 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 21.8 ttt180 -110.72 131.5 55.0 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.221 179.227 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 75.7 p -119.73 156.87 29.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.146 -179.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.46 177.7 44.94 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.103 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.553 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.0 m-85 -108.73 115.01 29.28 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.464 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.649 HG11 ' HB3' ' A' ' 20' ' ' GLU . 12.6 m -128.59 110.32 19.06 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.601 179.407 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.582 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 57.9 Cg_endo -72.41 32.41 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.406 2.071 . . . . 0.0 112.218 178.481 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.518 ' O ' HG13 ' A' ' 56' ' ' VAL . 11.7 t -68.4 84.81 0.27 Allowed 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.471 -179.917 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -64.65 -11.3 33.92 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.866 178.743 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -62.93 -9.84 11.32 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 179.591 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.518 HG13 ' O ' ' A' ' 53' ' ' SER . 6.2 p -117.91 139.1 46.37 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-O 121.022 0.439 . . . . 0.0 110.679 179.663 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -142.54 161.9 36.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.624 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.535 ' HB3' HG11 ' A' ' 7' ' ' VAL . 33.2 ptt-85 -71.14 141.12 50.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.875 0.369 . . . . 0.0 111.218 -179.803 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.6 tttt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.142 -0.932 . . . . 0.0 110.671 179.551 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.0 t . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 120.71 0.291 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.2 mt -115.37 118.38 58.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.333 -179.647 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.431 ' CG1' ' HG2' ' A' ' 58' ' ' ARG . 29.1 m -132.14 160.21 42.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.941 0.4 . . . . 0.0 111.278 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.414 HD11 HG22 ' A' ' 8' ' ' ILE . 35.3 mt -116.75 126.87 74.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.472 179.577 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.0 149.83 39.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.587 -179.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -112.37 -20.65 11.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.183 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.507 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 16.4 m-90 -140.42 150.58 44.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.641 -179.944 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.425 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 50.9 t0 -72.97 124.57 25.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.346 -179.322 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.424 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 57.1 t80 -127.52 133.89 49.81 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.577 179.621 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.5 m -101.51 139.15 37.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.047 0.451 . . . . 0.0 111.104 -179.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.503 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -55.23 129.72 39.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.693 -179.905 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -65.53 -31.8 73.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.118 0.485 . . . . 0.0 110.008 179.345 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.4 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 96.3 mt-30 -130.99 163.81 26.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.114 179.623 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -64.61 -34.69 78.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.97 0.414 . . . . 0.0 111.266 -179.622 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.1 -19.39 65.96 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.444 -179.882 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.75 ' HB3' HG12 ' A' ' 51' ' ' VAL . 1.9 mm-40 -82.63 -178.93 7.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.65 0.262 . . . . 0.0 111.175 -179.803 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.513 ' O ' HG11 ' A' ' 51' ' ' VAL . 26.1 tp -120.79 134.44 55.29 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.161 0.505 . . . . 0.0 112.167 -178.326 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -78.86 145.64 34.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.15 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.419 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 31.3 pt -132.66 163.82 36.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.071 179.129 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -114.6 -176.74 2.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.232 0.539 . . . . 0.0 111.514 -179.545 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.449 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 63.6 mttt -63.37 -57.47 10.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.938 -179.494 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -100.02 -12.73 19.48 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.47 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.42 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 77.1 tt0 -51.83 143.15 13.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.886 0.374 . . . . 0.0 111.681 -178.989 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -97.78 124.99 42.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.977 -179.858 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.577 ' HB3' HG23 ' A' ' 41' ' ' VAL . 1.7 mm? -114.27 143.3 45.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.064 0.459 . . . . 0.0 111.695 -179.254 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.0 m-90 -101.42 105.87 16.94 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.557 179.727 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.774 ' HB3' ' HD2' ' A' ' 34' ' ' ASP . 79.3 mt -69.87 149.87 47.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.303 0.573 . . . . 0.0 111.936 -179.024 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.563 HD22 ' N ' ' A' ' 32' ' ' LEU . 3.6 mm? -119.29 -31.88 4.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.797 -178.23 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -113.28 -83.74 0.6 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.114 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.774 ' HD2' ' HB3' ' A' ' 31' ' ' LEU . 18.2 m-20 72.01 3.84 4.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.899 -179.418 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.1 m -82.5 -36.04 26.82 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.886 0.374 . . . . 0.0 111.151 179.883 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -104.17 168.84 8.85 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.997 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 16.0 m -55.68 -30.31 60.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.673 178.494 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -97.56 126.97 43.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.854 178.253 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.495 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 42.5 m0 -106.88 134.22 50.35 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.582 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.476 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 58.4 ttp180 -92.24 127.21 37.63 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 177.475 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.577 HG23 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -135.1 161.73 39.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -178.293 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.1 ttm-85 -123.25 139.9 53.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.713 -179.547 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.404 ' HB2' HD23 ' A' ' 21' ' ' LEU . 52.4 t30 -110.34 161.57 15.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.864 0.364 . . . . 0.0 111.274 179.878 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.25 -21.03 46.77 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.552 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.93 5.03 14.97 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.836 179.735 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 72.78 22.57 3.1 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.852 0.358 . . . . 0.0 111.001 -179.637 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -107.23 132.44 53.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.158 179.242 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 73.2 p -127.27 151.0 49.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.696 0.284 . . . . 0.0 111.079 -179.592 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.479 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -170.5 172.84 44.27 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.577 -0.821 . . . . 0.0 113.115 -179.973 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.476 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 85.8 m-85 -101.52 114.04 27.7 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.641 0.258 . . . . 0.0 111.134 -179.905 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.75 HG12 ' HB3' ' A' ' 20' ' ' GLU . 15.7 m -136.05 114.15 10.77 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.737 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.24 43.21 0.84 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.164 1.909 . . . . 0.0 111.865 178.618 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.424 ' HB3' ' CD1' ' A' ' 13' ' ' TYR . 88.6 p -71.07 90.3 0.85 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.001 0.429 . . . . 0.0 111.282 -179.383 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -66.21 -12.68 57.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.371 178.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.507 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.0 m-85 -62.63 -12.95 26.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.159 -179.995 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -115.35 141.18 33.3 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.099 0 CA-C-O 120.95 0.405 . . . . 0.0 110.695 179.723 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -137.94 164.73 28.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.331 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.431 ' HG2' ' CG1' ' A' ' 7' ' ' VAL . 17.1 mtp-105 -69.93 143.88 52.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.66 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.142 -0.932 . . . . 0.0 110.992 179.947 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.409 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.5 t . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 120.82 0.343 . . . . 0.0 110.708 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.7 mt -113.87 116.06 51.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.98 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 23.0 m -132.23 161.1 41.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.837 0.351 . . . . 0.0 111.568 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.479 ' CD1' ' HD2' ' A' ' 59' ' ' LYS . 15.5 mt -119.0 123.0 70.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.288 -179.668 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.407 ' HA ' ' CG2' ' A' ' 56' ' ' VAL . . . -75.62 123.58 25.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.631 -179.718 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.422 ' HE3' ' HE2' ' A' ' 59' ' ' LYS . 38.8 mttp -93.7 -10.63 33.74 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.081 -179.955 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.74 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 11.1 m-90 -140.74 145.11 35.99 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.944 0.402 . . . . 0.0 110.839 179.841 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -72.81 122.21 21.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.083 -179.281 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.449 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 57.5 t80 -127.55 139.77 52.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.101 179.99 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 91.1 m -103.02 138.96 39.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.675 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.423 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -61.88 139.23 58.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.519 -179.667 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -87.83 -1.23 57.84 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.464 179.23 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.481 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 93.1 mt-30 -145.99 169.71 18.08 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 178.791 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -75.13 -33.36 61.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.106 0.479 . . . . 0.0 110.945 -179.645 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -71.43 -16.32 62.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.925 -179.635 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.577 ' HE2' ' HZ3' ' A' ' 38' ' ' TRP . 0.4 OUTLIER -86.56 178.73 6.98 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.022 -179.649 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.466 ' O ' HG13 ' A' ' 51' ' ' VAL . 7.1 mp -129.59 139.04 51.57 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-O 121.098 0.475 . . . . 0.0 111.859 -177.754 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -74.72 148.55 40.41 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.852 179.324 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 41.8 pt -129.29 164.0 32.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.911 179.221 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.416 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 96.9 mttt -118.99 163.64 16.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.141 0.496 . . . . 0.0 111.141 -179.858 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.468 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 10.8 pttm -63.87 -10.53 21.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.52 -0.764 . . . . 0.0 113.029 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -140.68 26.4 2.11 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.013 179.494 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.458 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 82.4 tt0 -102.03 143.11 32.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.046 0.45 . . . . 0.0 110.705 179.899 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.421 ' HG2' HG12 ' A' ' 8' ' ' ILE . 82.6 mtm-85 -95.33 119.41 33.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.291 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.543 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -116.12 145.21 43.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.128 -179.661 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -100.92 107.53 19.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.492 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.417 ' HA ' HG21 ' A' ' 41' ' ' VAL . 63.6 mt -77.9 149.66 34.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.119 0.485 . . . . 0.0 111.538 -179.583 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.474 HD11 ' HA ' ' A' ' 41' ' ' VAL . 4.8 mp -114.55 -29.84 6.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.039 179.795 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -157.05 115.0 3.19 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.883 0.373 . . . . 0.0 110.601 179.772 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.469 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 35.7 p-10 -106.28 2.34 26.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.229 -179.49 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 87.6 p -67.67 -37.63 82.62 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.904 0.383 . . . . 0.0 111.904 -179.351 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -81.61 162.08 23.24 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.328 0.585 . . . . 0.0 112.38 -179.044 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 17.1 p -57.55 -39.74 77.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.856 177.838 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.577 ' HZ3' ' HE2' ' A' ' 20' ' ' GLU . 54.3 m95 -96.97 130.21 44.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.47 -1.241 . . . . 0.0 108.745 177.791 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.469 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 38.2 m0 -102.62 132.97 48.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -177.862 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.481 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 51.9 ttt180 -87.45 132.07 34.12 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 177.794 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.543 HG23 ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -138.9 157.12 28.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.926 0.393 . . . . 0.0 111.81 -178.724 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -119.49 142.97 47.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.988 -179.664 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -113.08 163.16 15.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.391 -179.502 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.23 -20.68 43.73 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.463 179.769 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.79 5.79 8.8 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 179.679 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.1 m120 68.48 26.92 6.43 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 120.948 0.404 . . . . 0.0 111.307 -179.903 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -115.05 144.5 43.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.55 178.719 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 75.5 p -129.74 153.91 47.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.568 0.223 . . . . 0.0 110.715 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.401 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -169.02 176.12 43.24 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.552 -179.728 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.481 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 94.7 m-85 -108.13 114.6 28.62 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.217 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.534 HG11 ' HB3' ' A' ' 20' ' ' GLU . 6.0 m -133.16 111.22 12.98 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.812 179.255 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.499 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 13.7 Cg_exo -70.18 41.16 0.34 Allowed 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.734 2.29 . . . . 0.0 112.502 178.487 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.57 ' O ' HG11 ' A' ' 56' ' ' VAL . 6.7 p -69.03 74.19 0.3 Allowed 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 120.676 0.274 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -54.13 -17.51 2.82 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.146 -0.346 . . . . 0.0 111.223 178.708 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.74 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 91.1 m-85 -61.43 -8.06 3.71 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 179.26 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.57 HG11 ' O ' ' A' ' 53' ' ' SER . 9.2 p -111.2 140.15 31.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 O-C-N 121.386 -0.821 . . . . 0.0 110.727 179.808 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -136.55 150.57 48.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.224 179.803 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 33.6 ptt-85 -72.0 147.26 47.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.315 -179.465 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.479 ' HD2' ' CD1' ' A' ' 8' ' ' ILE . 98.5 mttt . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.306 -0.854 . . . . 0.0 110.82 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.458 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 79.2 t . . . . . 0 C--O 1.226 -0.176 0 CA-C-O 120.365 0.126 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.5 mt -105.59 114.71 45.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.712 0.291 . . . . 0.0 111.751 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.434 ' CG1' ' HG2' ' A' ' 58' ' ' ARG . 30.8 m -132.98 159.46 43.17 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.741 0.305 . . . . 0.0 110.987 179.054 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.583 ' HB ' ' HD2' ' A' ' 59' ' ' LYS . 54.3 mt -121.5 124.28 71.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.062 0.458 . . . . 0.0 111.395 179.96 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.13 124.76 27.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.085 -179.989 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -93.08 -9.18 40.5 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.837 -179.992 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.753 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 14.3 m-90 -143.58 147.06 33.84 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.866 0.365 . . . . 0.0 110.473 179.431 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.3 p-10 -73.67 124.04 25.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.438 -178.719 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.436 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 46.3 t80 -128.64 135.09 48.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.511 179.173 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 66.8 m -100.36 139.88 35.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.267 0.556 . . . . 0.0 111.489 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.512 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.43 130.51 46.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.488 179.813 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -65.16 -28.21 69.25 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.015 0.436 . . . . 0.0 110.246 179.106 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.405 ' O ' ' HB1' ' A' ' 15' ' ' ALA . 97.5 mt-30 -135.45 162.33 32.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.111 179.36 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -64.16 -29.91 71.0 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.904 0.383 . . . . 0.0 111.274 -179.705 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -69.48 -19.25 63.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.634 -179.757 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.512 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 2.3 mm-40 -82.55 -177.56 6.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.512 179.888 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.44 HD23 ' CG1' ' A' ' 41' ' ' VAL . 20.3 tp -123.7 133.14 53.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.138 0.494 . . . . 0.0 111.692 -178.913 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -77.65 148.56 34.97 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.806 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.436 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 36.6 pt -131.93 163.56 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.335 179.39 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.412 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 73.4 mmtt -118.38 164.2 15.6 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.144 0.497 . . . . 0.0 111.352 179.919 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.487 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 33.4 pttt -65.74 -11.11 42.91 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -179.671 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -140.6 23.34 2.3 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.168 179.638 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.474 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 78.6 tt0 -102.62 139.73 37.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.067 0.46 . . . . 0.0 110.695 179.939 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.545 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 11.9 ptp180 -95.25 121.38 36.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.212 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.519 ' HB3' HG22 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -113.58 152.69 29.96 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.517 -178.966 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.411 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 11.2 m-90 -103.36 105.57 15.87 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.501 -179.661 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.458 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 71.8 mt -77.63 146.34 36.19 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.076 0.465 . . . . 0.0 111.865 -179.335 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.476 HD11 ' HA ' ' A' ' 41' ' ' VAL . 4.9 mp -110.63 -29.53 7.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.203 179.976 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -158.96 116.74 2.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.865 0.364 . . . . 0.0 110.698 -179.672 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.462 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 42.6 p-10 -108.83 4.49 23.62 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.114 -179.381 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.7 m -68.32 -35.57 77.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.84 0.352 . . . . 0.0 111.383 -179.429 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -84.27 158.4 21.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.071 -179.162 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.3 p -55.36 -40.65 71.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.337 -0.847 . . . . 0.0 108.841 177.74 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.568 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 56.2 m95 -93.84 129.28 40.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.452 -1.249 . . . . 0.0 109.102 177.845 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.477 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 37.4 m0 -101.16 137.61 39.29 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.055 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.48 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 64.5 ttt180 -93.03 135.36 34.27 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 177.443 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.519 HG22 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -145.63 159.19 12.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.569 -178.935 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.421 ' HB2' HG21 ' A' ' 48' ' ' THR . 78.1 ttt180 -124.02 144.08 50.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.154 179.999 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -113.43 163.35 14.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.308 179.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.42 -24.7 63.7 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.662 -179.974 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.28 5.72 8.03 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.691 179.059 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 71.92 20.55 4.41 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.314 0.245 . . . . 0.0 111.08 -179.813 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.405 ' HG2' HD13 ' A' ' 21' ' ' LEU . 77.0 ttt180 -105.89 125.16 50.66 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.597 179.644 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.421 HG21 ' HB2' ' A' ' 42' ' ' ARG . 76.9 p -121.13 149.86 42.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.126 -179.732 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.62 176.74 40.43 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.639 179.719 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.48 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 85.7 m-85 -107.64 110.85 22.83 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.878 0.339 . . . . 0.0 111.579 -179.87 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.441 HG12 ' HB3' ' A' ' 20' ' ' GLU . 12.1 m -134.08 117.05 13.55 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 111.493 0.183 . . . . 0.0 111.493 179.515 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.568 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 57.6 Cg_endo -71.75 53.47 1.87 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.319 2.013 . . . . 0.0 111.613 179.111 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.406 ' O ' HG11 ' A' ' 56' ' ' VAL . 1.8 m -66.92 92.99 0.25 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.093 -179.513 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.3 m120 -77.26 -10.4 59.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.902 0.382 . . . . 0.0 110.186 178.055 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.753 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 86.1 m-85 -81.37 6.24 15.03 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.323 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.406 HG11 ' O ' ' A' ' 53' ' ' SER . 13.2 p -118.08 144.66 25.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 O-C-N 121.946 -0.472 . . . . 0.0 110.51 179.591 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -128.09 156.82 42.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.824 -179.674 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.434 ' HG2' ' CG1' ' A' ' 7' ' ' VAL . 17.1 mtp-105 -73.43 142.44 46.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.793 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.583 ' HD2' ' HB ' ' A' ' 8' ' ' ILE . 56.3 mttm . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.876 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.401 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 58.6 t . . . . . 0 N--CA 1.455 -0.209 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.423 HG12 ' CD1' ' A' ' 30' ' ' TRP . 50.3 mt -111.28 117.39 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.008 179.8 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 32.9 m -131.18 160.79 42.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.071 179.646 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.494 HD11 ' HD2' ' A' ' 59' ' ' LYS . 16.8 mt -119.84 122.17 67.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.822 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.01 124.33 27.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.265 -179.925 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.423 ' CE ' ' HE2' ' A' ' 59' ' ' LYS . 94.8 mttt -92.97 -11.05 34.21 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.905 179.813 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.66 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 9.2 m-90 -140.42 146.51 38.4 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.744 0.307 . . . . 0.0 110.553 -179.762 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -75.57 124.08 26.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.238 0.542 . . . . 0.0 111.553 -178.371 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.468 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 59.0 t80 -128.05 136.48 51.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.623 179.683 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 59.6 m -103.82 139.99 38.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.815 179.777 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.458 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -58.06 137.09 57.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.891 -179.937 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -86.72 -3.77 59.09 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.234 178.486 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.442 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 81.5 mm-40 -143.07 162.64 34.97 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.857 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -71.93 -19.67 61.87 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.706 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -89.21 -10.67 46.16 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -179.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.55 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 1.1 mt-10 -83.33 179.54 7.66 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.036 0.446 . . . . 0.0 110.247 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.674 HD22 ' HB2' ' A' ' 43' ' ' ASN . 15.9 tp -122.84 128.49 50.45 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.914 -178.394 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -71.76 147.62 47.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.41 179.729 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.468 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 40.1 pt -132.23 161.87 40.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.761 179.461 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 99.0 mttt -117.67 163.09 16.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.073 0.464 . . . . 0.0 111.226 -179.87 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.452 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 55.4 pttt -64.18 -12.17 37.79 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -179.667 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -138.84 22.94 2.65 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.942 179.355 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.44 ' HG3' HD22 ' A' ' 29' ' ' LEU . 51.6 tp10 -100.12 140.93 33.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.105 0.478 . . . . 0.0 111.219 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.437 ' HG2' HG12 ' A' ' 8' ' ' ILE . 61.2 mtt85 -91.94 122.43 34.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.704 -179.852 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.652 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.4 mm? -115.29 145.31 42.6 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.612 -178.386 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.423 ' CD1' HG12 ' A' ' 6' ' ' ILE . 6.3 m0 -101.65 107.63 18.94 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.547 179.648 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.408 ' HA ' HG22 ' A' ' 41' ' ' VAL . 92.9 mt -79.18 148.83 32.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.342 0.591 . . . . 0.0 112.146 -179.205 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.461 HD11 ' HG2' ' A' ' 40' ' ' ARG . 4.9 mp -112.06 -28.96 7.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.486 179.181 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -161.05 118.08 2.31 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.264 179.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.478 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.6 p-10 -113.22 11.76 18.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.111 -179.472 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.2 p -71.21 -37.87 72.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.913 0.387 . . . . 0.0 111.288 -179.678 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.07 160.95 20.84 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.411 0.624 . . . . 0.0 112.344 -179.269 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 36.5 p -55.3 -40.37 71.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.061 178.002 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.536 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 50.7 m95 -92.39 132.67 36.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.819 177.812 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.478 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -106.84 138.67 42.58 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.054 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.476 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 56.2 ttt180 -96.1 129.08 43.48 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.161 177.867 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.652 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.4 p -141.74 159.23 21.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -177.987 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.432 ' CB ' HG23 ' A' ' 48' ' ' THR . 71.3 ttt180 -124.07 141.87 51.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.289 -179.627 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.674 ' HB2' HD22 ' A' ' 21' ' ' LEU . 48.7 t30 -110.12 162.69 14.32 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 120.985 0.422 . . . . 0.0 111.021 179.281 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.01 -19.32 51.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.922 178.608 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.56 5.59 8.79 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.027 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 66.56 26.96 9.76 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.165 0.507 . . . . 0.0 111.105 -179.455 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.3 ttm-85 -113.79 125.32 53.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.822 178.957 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.432 HG23 ' CB ' ' A' ' 42' ' ' ARG . 77.6 p -118.51 143.59 46.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.936 0.398 . . . . 0.0 111.554 -179.221 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.55 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -161.06 172.01 37.23 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.75 179.961 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.476 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 95.7 m-85 -104.71 107.87 19.04 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 117.019 0.409 . . . . 0.0 111.995 -179.432 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.421 HG11 ' H ' ' A' ' 21' ' ' LEU . 11.4 m -122.75 120.12 27.85 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.305 178.744 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.536 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 61.7 Cg_endo -73.54 31.59 0.32 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.39 2.06 . . . . 0.0 112.542 178.484 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.411 ' H ' ' C ' ' A' ' 51' ' ' VAL . 86.4 p -61.72 93.95 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 120.997 0.427 . . . . 0.0 111.178 -179.641 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -78.6 -4.85 50.93 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.593 178.321 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.66 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 86.1 m-85 -72.18 -9.77 58.89 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.405 179.22 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.9 p -120.2 139.71 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 121.187 0.518 . . . . 0.0 110.614 -179.819 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -144.1 160.21 41.29 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.072 179.88 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 77.9 ttt-85 -69.4 138.57 53.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.928 0.394 . . . . 0.0 110.919 -179.688 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.494 ' HD2' HD11 ' A' ' 8' ' ' ILE . 95.2 mttt . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.839 -179.901 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.447 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.0 t . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.438 HG21 ' CD1' ' A' ' 30' ' ' TRP . 8.4 mt -109.88 117.02 53.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.388 -179.743 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 33.1 m -131.94 160.35 42.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.831 0.348 . . . . 0.0 111.157 179.466 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.472 HG12 ' HG2' ' A' ' 28' ' ' ARG . 21.4 mt -117.63 126.66 74.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.844 179.735 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 27' ' ' GLU . . . -74.79 149.68 39.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.147 0.498 . . . . 0.0 110.867 -179.885 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -112.02 -21.43 11.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.948 179.87 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.495 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 20.3 m-90 -139.26 151.3 46.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.838 179.991 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.446 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 57.1 t0 -74.59 125.45 28.67 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.07 0.462 . . . . 0.0 111.196 -178.761 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.464 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 61.2 t80 -128.08 137.5 52.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.942 179.813 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.8 t -103.49 139.28 39.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.651 179.784 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.486 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.19 129.81 43.41 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.42 -179.935 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mm-40 -62.85 -33.46 75.3 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.308 0.575 . . . . 0.0 110.186 179.471 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -131.39 161.67 31.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.205 179.739 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -62.03 -33.9 75.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.084 0.469 . . . . 0.0 111.288 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -65.87 -20.16 66.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.202 179.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.528 ' HB3' HG13 ' A' ' 51' ' ' VAL . 2.8 mm-40 -83.32 179.24 7.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 0.0 110.979 -179.663 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.419 HD13 ' ND2' ' A' ' 43' ' ' ASN . 39.8 tp -121.7 126.06 48.09 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.893 -178.547 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -73.18 159.07 34.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.804 179.314 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.464 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 41.5 pt -141.83 166.87 16.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.366 179.807 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 57.1 mttm -114.48 178.67 4.2 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.215 0.531 . . . . 0.0 111.524 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.463 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 20.6 mttp -61.49 -52.31 65.03 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.234 -179.543 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -107.13 -1.36 22.04 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -178.097 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.462 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 79.5 tt0 -62.89 144.43 56.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.233 0.539 . . . . 0.0 111.205 -179.541 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.472 ' HG2' HG12 ' A' ' 8' ' ' ILE . 75.5 mtp180 -100.36 120.82 40.53 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.313 -179.984 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.69 ' HB3' HG22 ' A' ' 41' ' ' VAL . 1.2 mm? -111.65 149.37 31.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.549 -178.758 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.438 ' CD1' HG21 ' A' ' 6' ' ' ILE . 5.2 m-90 -103.91 107.73 18.75 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.126 179.709 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.447 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 88.0 mt -76.23 147.68 38.18 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.031 0.443 . . . . 0.0 111.996 -179.172 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.509 HD11 ' HA ' ' A' ' 41' ' ' VAL . 5.2 mp -109.8 -28.93 8.54 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.596 179.482 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -160.97 117.71 2.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.69 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.497 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.5 p-10 -110.53 3.04 19.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.132 -179.558 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.6 m -63.96 -38.4 90.93 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.772 0.32 . . . . 0.0 111.61 -179.735 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.69 162.76 19.57 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.331 0.586 . . . . 0.0 112.506 -179.075 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.6 p -58.94 -37.23 76.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.244 178.291 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.61 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 68.6 m95 -94.77 131.05 41.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.579 -1.191 . . . . 0.0 108.525 177.959 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.497 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -105.44 137.08 43.84 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.99 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.49 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 69.2 ttt180 -94.61 129.9 41.27 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.048 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.69 HG22 ' HB3' ' A' ' 29' ' ' LEU . 2.4 p -143.29 155.1 16.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 C-N-CA 120.382 -0.527 . . . . 0.0 112.155 -178.384 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 28.4 ttp-105 -123.74 142.2 51.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.912 -179.613 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.419 ' ND2' HD13 ' A' ' 21' ' ' LEU . 43.6 p-10 -111.65 171.66 7.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.676 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.5 -26.72 68.69 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.381 -179.978 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.37 5.4 2.3 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 179.451 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 66.57 25.14 10.08 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.092 0.472 . . . . 0.0 111.026 -179.404 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -110.32 127.8 55.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.598 178.945 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.8 p -121.79 145.63 47.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.724 0.297 . . . . 0.0 110.878 -179.344 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.467 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.92 170.46 39.99 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.996 179.73 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.49 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 90.6 m-85 -101.56 112.45 25.01 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -179.436 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.528 HG13 ' HB3' ' A' ' 20' ' ' GLU . 15.8 m -135.22 116.09 12.05 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.59 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.61 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 63.2 Cg_endo -73.09 45.44 0.95 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.384 2.056 . . . . 0.0 111.903 179.044 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.6 p -70.21 85.22 0.56 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.792 -179.663 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -63.9 -14.6 54.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.008 0.432 . . . . 0.0 110.443 178.724 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.495 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 94.4 m-85 -61.32 -14.6 28.24 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.624 179.367 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.3 p -118.23 140.03 43.19 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 CA-C-O 121.182 0.515 . . . . 0.0 111.201 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -145.5 159.13 43.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.381 179.676 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -71.0 135.2 47.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.839 0.352 . . . . 0.0 110.842 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.054 179.656 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.7 mmm . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.838 0.351 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 67.4 p -78.37 148.31 33.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.08 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -97.98 139.28 34.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.091 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.794 ' HE2' ' HG ' ' A' ' 32' ' ' LEU . 72.3 mm-40 -97.18 137.74 35.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.174 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.414 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 79.9 t -112.09 129.93 66.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.377 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 30.3 mm -98.49 114.58 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.16 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 22.4 m -132.25 165.66 31.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.969 0.414 . . . . 0.0 111.259 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.4 mt -128.84 129.02 68.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.51 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.93 141.14 45.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.605 -178.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -105.11 -20.18 13.6 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.746 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.546 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 18.4 m-90 -140.98 150.67 43.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.973 0.416 . . . . 0.0 110.027 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.8 p-10 -69.56 129.72 40.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.216 0.531 . . . . 0.0 112.072 -178.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -127.9 140.58 51.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.772 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.9 t -105.85 138.47 41.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.599 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.91 138.32 57.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.38 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -86.09 -3.26 58.91 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.364 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -146.17 170.15 17.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.708 0.29 . . . . 0.0 110.283 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -74.02 -27.29 60.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.497 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -80.56 -9.71 59.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.505 ' HB3' HG13 ' A' ' 51' ' ' VAL . 0.5 OUTLIER -93.26 171.98 8.58 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.758 -179.889 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.466 ' O ' HG12 ' A' ' 51' ' ' VAL . 8.0 mp -120.19 134.88 55.15 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -74.62 147.0 42.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.424 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 46.0 pt -127.73 169.4 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.022 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -117.34 -176.74 3.07 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.158 0.504 . . . . 0.0 111.85 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -65.85 -37.55 86.5 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.786 -178.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -126.78 39.06 4.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.873 0.368 . . . . 0.0 111.409 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -100.37 132.41 45.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 50.9 mtm105 -88.08 125.7 34.71 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.451 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.467 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 1.1 mm? -116.07 150.31 37.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.824 -178.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 31.1 m-90 -102.62 105.82 16.38 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.442 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.437 ' HA ' HG21 ' A' ' 41' ' ' VAL . 88.4 mt -79.62 142.55 35.51 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.927 0.394 . . . . 0.0 112.028 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.794 ' HG ' ' HE2' ' A' ' 4' ' ' GLU . 3.9 mp -111.3 -29.11 7.95 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.186 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -158.57 117.6 3.07 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.861 0.363 . . . . 0.0 111.251 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.422 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.4 p-10 -110.56 4.84 20.68 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.2 m -67.79 -36.22 80.05 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.815 0.341 . . . . 0.0 111.326 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -83.54 158.61 21.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.667 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 89.6 m -56.35 -35.22 67.38 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.332 178.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.9 m0 -99.15 133.05 43.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.422 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 42.2 m0 -104.39 134.68 47.19 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.42 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 53.4 ttt180 -86.62 133.08 33.73 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 178.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.473 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -137.78 161.49 33.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.02 0.438 . . . . 0.0 111.91 -177.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -124.24 149.7 46.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.621 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -121.81 160.72 24.05 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.08 0.466 . . . . 0.0 111.488 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.97 -19.83 13.98 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.6 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.99 5.35 11.91 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 72.56 22.74 3.23 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 122.527 0.331 . . . . 0.0 111.452 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -108.19 146.43 32.78 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 75.6 p -134.95 147.78 49.86 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.846 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.26 174.72 43.7 Favored Glycine 0 C--N 1.339 0.733 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.29 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.42 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 89.4 m-85 -102.59 108.31 19.54 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.505 HG13 ' HB3' ' A' ' 20' ' ' GLU . 22.3 m -127.32 115.87 21.52 Favored Pre-proline 0 CA--C 1.533 0.314 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.1 63.65 4.19 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 121.564 1.51 . . . . 0.0 110.968 178.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -72.98 76.72 1.18 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.516 -178.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -60.45 -19.17 55.52 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.208 177.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.546 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 71.5 m-85 -86.91 44.21 1.15 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.004 -0.544 . . . . 0.0 112.122 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.9 p -136.36 146.77 28.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.838 0.352 . . . . 0.0 111.001 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -122.82 140.12 53.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.312 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -75.25 139.97 42.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.854 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.855 179.697 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ptp . . . . . 0 N--CA 1.501 2.119 0 CA-C-O 120.99 0.424 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.4 p -74.51 150.42 39.82 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.238 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -99.83 125.8 45.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.021 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -84.96 143.96 28.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.024 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.7 t -108.02 128.58 63.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.709 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.1 mt -107.32 115.52 48.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.197 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 21.5 m -128.83 161.09 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 111.411 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 16.2 mt -119.83 128.72 75.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.12 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -84.71 117.46 23.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.004 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -90.92 -3.71 57.1 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.489 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 15.9 m-90 -147.08 141.65 26.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.785 0.326 . . . . 0.0 110.377 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.2 p-10 -71.31 120.0 16.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.847 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -127.62 137.11 52.45 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.57 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.6 m -99.93 141.97 32.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.748 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.451 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.48 131.98 51.77 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.792 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -63.72 -30.94 71.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.118 0.485 . . . . 0.0 110.184 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -137.69 160.89 37.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.256 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -59.54 -35.07 73.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.935 0.398 . . . . 0.0 111.169 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -65.19 -20.11 66.29 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.282 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.451 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 3.0 mm-40 -83.79 -179.35 7.27 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.59 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.46 HD21 ' HB2' ' A' ' 43' ' ' ASN . 24.1 tp -120.57 140.53 51.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.028 0.442 . . . . 0.0 112.085 -178.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -84.2 146.45 27.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.65 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 45.3 pt -131.36 160.99 41.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.192 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -116.71 167.24 11.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.073 0.464 . . . . 0.0 111.386 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.426 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 52.1 pttt -67.21 -14.86 63.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.79 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -140.0 22.21 2.44 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.671 -0.411 . . . . 0.0 111.561 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -99.67 135.42 41.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.899 0.38 . . . . 0.0 110.516 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 69.2 mtp180 -90.53 120.77 31.9 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.754 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.446 ' N ' ' CD2' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -115.69 148.0 40.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.577 -179.601 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -101.62 109.77 21.63 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.079 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.434 HD23 ' CE3' ' A' ' 39' ' ' TRP . 0.2 OUTLIER -81.02 152.63 27.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.383 0.611 . . . . 0.0 112.255 -179.05 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -110.93 -25.4 9.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.07 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -160.99 117.41 2.26 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.745 0.307 . . . . 0.0 111.067 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.5 p-10 -110.8 7.18 21.89 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 86.0 p -74.1 -36.57 64.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.82 0.343 . . . . 0.0 111.371 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -81.1 161.41 24.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.371 0.605 . . . . 0.0 112.31 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 17.6 p -57.55 -40.5 79.02 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.007 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.449 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 43.8 m95 -93.94 131.17 39.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.918 177.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.434 ' CE3' HD23 ' A' ' 31' ' ' LEU . 32.0 m0 -102.67 129.68 49.34 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.433 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 44.3 ttt180 -91.78 127.17 37.13 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.441 ' CG2' ' HB3' ' A' ' 29' ' ' LEU . 3.2 p -140.16 161.97 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -177.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.9 ttt85 -126.23 145.51 50.37 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.723 0.297 . . . . 0.0 111.202 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.46 ' HB2' HD21 ' A' ' 21' ' ' LEU . 61.8 t30 -113.19 161.54 17.04 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.917 0.389 . . . . 0.0 111.824 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.98 -21.05 58.01 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.262 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.65 6.35 15.45 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 68.05 26.07 7.37 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.949 0.404 . . . . 0.0 111.26 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -110.23 123.44 49.78 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 52.5 p -121.74 156.94 32.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.749 0.309 . . . . 0.0 111.208 -179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.436 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -173.48 171.03 44.18 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.365 -0.922 . . . . 0.0 113.308 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 90.4 m-85 -103.54 112.53 25.49 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.747 0.308 . . . . 0.0 111.28 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.9 m -132.29 114.74 14.85 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.03 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.449 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 8.7 Cg_exo -73.63 36.99 0.4 Allowed 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.721 2.281 . . . . 0.0 113.026 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.69 92.98 0.35 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 120.865 0.364 . . . . 0.0 111.267 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -62.17 -17.55 58.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.281 178.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.489 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.0 m-85 -59.93 -14.82 17.48 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 8.1 p -112.72 140.44 32.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.083 0.468 . . . . 0.0 110.835 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -136.82 165.24 26.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.064 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -69.55 139.43 53.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.915 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.7 pttp . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.738 179.977 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.7 mtm . . . . . 0 N--CA 1.501 2.096 0 CA-C-O 120.905 0.383 . . . . 0.0 111.666 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 90.8 m -82.13 131.23 35.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.864 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -61.75 -35.81 79.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.02 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -69.67 139.12 53.46 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.936 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.448 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.1 t -110.35 130.02 64.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.627 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.8 mt -111.67 118.32 57.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.673 0.273 . . . . 0.0 111.709 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.425 ' CG1' ' HG2' ' A' ' 58' ' ' ARG . 21.4 m -134.11 160.67 41.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.034 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.44 ' HA ' ' HA ' ' A' ' 28' ' ' ARG . 33.6 mt -121.07 124.05 71.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.312 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.76 125.2 28.61 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.932 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.1 mttm -90.99 -9.24 46.72 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.543 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 12.5 m-90 -146.64 145.98 30.24 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.867 0.365 . . . . 0.0 110.876 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -69.91 125.23 26.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.995 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.431 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 65.6 t80 -127.81 141.16 51.65 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.502 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -104.19 136.66 43.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.922 0.392 . . . . 0.0 110.897 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.421 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.26 133.04 54.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.384 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -65.77 -34.27 77.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.187 0.518 . . . . 0.0 110.182 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -131.83 163.94 27.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.329 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -63.52 -31.15 72.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.864 0.364 . . . . 0.0 111.335 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -63.38 -27.25 69.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.301 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.421 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -82.6 -179.19 7.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.27 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.408 ' N ' HD13 ' A' ' 21' ' ' LEU . 6.4 mp -124.73 143.89 50.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.007 0.432 . . . . 0.0 111.345 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -81.44 148.78 29.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.407 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.431 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 49.8 pt -130.96 162.89 38.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.262 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -116.29 171.51 7.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.811 0.339 . . . . 0.0 110.873 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 16.1 ptpt -69.45 -10.99 60.42 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.7 p-10 -138.46 25.32 2.65 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.714 -0.395 . . . . 0.0 111.366 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.417 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 78.6 tt0 -101.08 139.16 37.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.783 0.325 . . . . 0.0 111.162 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.44 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 35.8 ptt180 -99.01 121.25 40.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.95 0.405 . . . . 0.0 111.305 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.493 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 0.5 OUTLIER -115.28 153.98 29.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.555 -179.564 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -101.96 112.31 24.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.687 0.28 . . . . 0.0 111.517 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.448 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 40.2 mt -78.19 145.03 35.82 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.928 0.394 . . . . 0.0 111.455 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.8 mp -111.27 -27.09 8.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.324 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -157.52 115.93 3.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.853 0.359 . . . . 0.0 111.038 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.434 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -107.14 4.14 26.5 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.3 t -68.94 -36.66 78.22 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.865 0.364 . . . . 0.0 111.441 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -81.83 159.18 23.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.859 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 86.1 m -59.82 -35.66 75.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.194 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.492 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 8.8 m0 -99.99 125.2 45.99 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.434 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 42.5 m0 -94.96 138.44 32.69 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.431 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 66.6 ttt180 -91.83 137.54 32.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.493 ' CG2' ' HB3' ' A' ' 29' ' ' LEU . 0.6 OUTLIER -140.4 161.44 24.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.619 -0.433 . . . . 0.0 112.134 -178.146 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 46.1 ttp180 -123.48 143.88 49.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.784 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -111.2 162.88 14.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.431 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.9 -19.89 20.23 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.739 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.25 6.0 15.43 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 69.96 24.77 5.05 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-O 120.786 0.327 . . . . 0.0 110.983 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -111.09 128.77 55.99 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.048 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 72.8 p -116.91 156.82 26.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.926 0.393 . . . . 0.0 111.16 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.59 178.4 43.91 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.038 -0.601 . . . . 0.0 112.087 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.431 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 97.1 m-85 -106.86 112.31 25.22 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.924 0.392 . . . . 0.0 111.109 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.7 t -124.54 112.16 27.7 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.658 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.492 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 7.5 Cg_exo -72.9 36.6 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.514 2.143 . . . . 0.0 112.759 178.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.439 ' O ' HG13 ' A' ' 56' ' ' VAL . 61.9 p -65.06 97.72 0.26 Allowed 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 120.599 0.238 . . . . 0.0 110.899 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -80.73 -3.68 51.7 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.078 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.543 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 81.1 m-85 -76.74 -1.61 28.88 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.439 HG13 ' O ' ' A' ' 53' ' ' SER . 7.3 p -111.66 142.03 25.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 121.076 0.465 . . . . 0.0 110.859 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.42 ' N ' HG21 ' A' ' 56' ' ' VAL . 83.9 tt0 -125.86 145.4 50.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.028 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.425 ' HG2' ' CG1' ' A' ' 7' ' ' VAL . 64.6 mtp180 -69.3 135.69 50.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.962 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.2 mttp . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.865 179.404 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttm . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.888 0.375 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 68.8 p -75.32 149.11 38.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.984 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -102.12 131.29 48.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.123 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -75.25 139.28 42.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.506 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.6 t -116.99 129.38 73.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.362 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.3 mt -117.54 123.53 71.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.638 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 29.8 m -134.37 159.6 41.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.221 0.534 . . . . 0.0 112.053 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 24.2 mt -117.15 127.13 74.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.093 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.38 148.72 43.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.95 -179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -113.85 -16.48 12.23 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.589 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.486 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 11.6 m-90 -145.21 148.39 33.48 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.913 0.387 . . . . 0.0 110.325 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -68.49 126.51 29.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.667 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.409 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 45.7 t80 -127.25 135.78 51.09 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.163 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.3 m -105.52 120.77 42.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.026 0.441 . . . . 0.0 110.081 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.493 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . . . -52.92 143.46 16.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.048 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -129.51 40.45 3.59 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.185 0.517 . . . . 0.0 111.473 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.495 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 86.8 mm-40 -135.52 176.41 8.7 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.861 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -78.24 -38.68 42.41 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -122.95 77.69 1.48 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.218 0.532 . . . . 0.0 109.94 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.582 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -138.95 -179.39 5.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.408 -177.715 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.429 HD21 ' HB2' ' A' ' 43' ' ' ASN . 8.9 mp -137.01 137.39 39.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.101 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.9 p-10 -80.18 150.07 30.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.995 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.409 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 46.4 pt -129.44 164.17 32.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 120.655 0.264 . . . . 0.0 110.7 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -112.91 -177.59 3.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.28 0.562 . . . . 0.0 111.451 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -61.44 -52.25 65.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.827 -178.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -105.91 -7.89 17.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.419 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 80.5 tt0 -54.67 146.21 17.3 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.789 0.328 . . . . 0.0 111.515 -179.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 -107.32 125.48 51.23 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.446 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.45 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 0.5 OUTLIER -116.26 156.24 26.94 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.796 0.331 . . . . 0.0 110.738 179.737 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -104.68 106.61 17.18 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.647 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.502 ' HA ' HG22 ' A' ' 41' ' ' VAL . 25.9 mt -68.53 143.42 54.94 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.513 0.673 . . . . 0.0 112.13 -178.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.485 HD21 ' N ' ' A' ' 32' ' ' LEU . 3.9 mm? -112.48 -35.86 5.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.631 -178.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -157.15 115.33 3.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.432 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.421 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 38.4 p-10 -111.99 4.31 18.04 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.3 m -67.47 -39.3 85.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.791 0.329 . . . . 0.0 111.606 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -81.27 159.59 24.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.782 -179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -35.24 68.61 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.444 ' CE3' ' HG3' ' A' ' 52' ' ' PRO . 16.8 m95 -96.22 131.18 42.97 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 177.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.421 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -104.07 135.44 45.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.168 0.509 . . . . 0.0 112.313 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.416 ' HA ' ' O ' ' A' ' 49' ' ' GLY . 75.2 ttt180 -94.65 130.29 41.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 31' ' ' LEU . 1.4 p -137.03 157.3 35.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -120.55 141.58 50.13 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.075 -178.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.429 ' HB2' HD21 ' A' ' 21' ' ' LEU . 60.3 t30 -113.18 163.18 15.09 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.676 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.73 -18.94 5.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.17 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.43 6.43 10.24 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 66.05 26.1 10.81 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.052 0.453 . . . . 0.0 111.043 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -112.32 143.55 43.24 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.463 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 73.1 p -132.76 161.61 33.61 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.791 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.582 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -177.81 -176.34 45.74 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.966 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.421 ' O ' ' HB3' ' A' ' 20' ' ' GLU . 93.6 m-85 -110.69 115.19 29.14 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -178.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.4 m -137.91 112.75 8.97 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.971 178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.444 ' HG3' ' CE3' ' A' ' 38' ' ' TRP . 2.7 Cg_exo -74.77 56.35 4.09 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.145 1.897 . . . . 0.0 111.371 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.08 82.24 1.27 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.073 0.463 . . . . 0.0 111.707 -178.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -64.64 -14.78 59.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.638 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.486 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.6 m-85 -71.1 -7.17 44.72 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.3 p -110.03 146.58 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.94 0.4 . . . . 0.0 110.888 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -136.59 162.43 33.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.506 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -69.39 140.89 54.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.771 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.979 179.853 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.3 mtm . . . . . 0 N--CA 1.498 1.95 0 CA-C-O 120.843 0.354 . . . . 0.0 111.754 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 65.1 m -80.0 137.95 36.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.922 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.75 134.33 35.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.999 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -100.32 138.39 37.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.418 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.464 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 57.9 t -115.34 133.7 60.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.251 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.1 mt -103.11 119.25 51.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.665 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 35.1 m -132.29 160.24 42.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.564 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 26.0 mm -118.48 123.96 72.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.922 0.392 . . . . 0.0 111.329 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.38 120.52 21.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.514 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -93.01 -6.74 47.64 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.565 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 6.8 m-90 -143.99 143.78 31.37 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.796 0.331 . . . . 0.0 110.399 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -71.38 121.66 18.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.048 0.451 . . . . 0.0 111.722 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.418 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 54.2 t80 -127.18 135.52 50.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.692 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.4 m -102.73 141.73 35.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.016 0.436 . . . . 0.0 110.93 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.485 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -55.76 135.17 51.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.675 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -84.97 -4.87 59.31 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.697 0.284 . . . . 0.0 110.959 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.431 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 74.9 mt-30 -143.9 171.73 13.83 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -76.37 -28.79 56.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.894 0.378 . . . . 0.0 111.775 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -81.36 -6.7 59.19 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.536 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 1.1 mt-10 -86.04 179.09 7.04 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.736 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.438 HD23 ' N ' ' A' ' 43' ' ' ASN . 28.8 tp -124.27 126.57 46.29 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.997 0.427 . . . . 0.0 111.672 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -68.95 149.51 48.76 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.027 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 46.4 pt -134.88 165.24 31.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.249 179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -118.88 166.97 12.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.055 0.455 . . . . 0.0 111.353 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.407 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 55.4 pttt -67.22 -12.56 60.38 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -139.73 21.4 2.5 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.364 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -97.88 141.15 31.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.901 0.381 . . . . 0.0 110.636 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.9 ptt-85 -98.72 120.63 39.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.571 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.435 ' N ' ' CD2' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -113.75 148.17 36.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.032 0.444 . . . . 0.0 111.693 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 15.8 m-90 -99.83 111.31 23.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.979 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.464 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 62.4 mt -72.95 147.32 45.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.809 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mp -109.51 -30.89 7.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.415 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -133.72 -66.37 0.64 Allowed 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 120.809 0.338 . . . . 0.0 111.483 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.461 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 3.2 p30 51.6 16.41 0.45 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.621 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.6 m -77.93 -35.87 50.01 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.912 0.387 . . . . 0.0 110.89 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.4 mmtt -92.34 175.3 6.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.646 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.9 m -59.15 -27.86 66.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.723 178.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.477 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 49.4 m95 -99.75 127.64 45.88 Favored 'General case' 0 CA--C 1.522 -0.114 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 177.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.461 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 38.4 m0 -108.23 128.51 54.78 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -176.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.452 ' HB2' ' CE1' ' A' ' 50' ' ' TYR . 23.5 ttm180 -87.84 135.94 33.17 Favored 'General case' 0 C--O 1.231 0.087 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 177.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 1.4 p -145.36 161.9 12.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.221 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -120.84 144.06 48.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.009 0.433 . . . . 0.0 111.606 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.438 ' N ' HD23 ' A' ' 21' ' ' LEU . 55.9 t30 -114.33 161.12 18.31 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.319 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.38 -20.39 29.25 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.816 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.85 6.4 13.24 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 67.69 26.02 7.99 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.062 0.458 . . . . 0.0 111.121 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 85.6 mtt-85 -111.72 128.54 56.12 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.647 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 30.5 p -125.61 151.4 46.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.336 -179.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.536 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -172.47 172.64 45.04 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.685 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 40' ' ' ARG . 52.6 m-85 -96.75 108.55 21.22 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.2 m -126.91 111.36 22.06 Favored Pre-proline 0 C--N 1.333 -0.116 0 CA-C-N 116.794 -0.185 . . . . 0.0 111.208 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.477 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 60.5 Cg_endo -72.23 46.46 0.93 Allowed 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 121.788 1.659 . . . . 0.0 111.733 178.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.418 ' HB3' ' CD1' ' A' ' 13' ' ' TYR . 9.1 p -72.99 81.62 1.21 Allowed 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 120.973 0.416 . . . . 0.0 111.112 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 p30 -58.05 -19.45 31.67 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.113 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.565 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.6 m-85 -57.22 -16.92 9.36 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.724 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -108.98 140.57 27.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.045 0.45 . . . . 0.0 110.859 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -135.42 162.56 32.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.026 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -70.08 139.14 52.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.912 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.3 tttp . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.953 -179.929 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.0 mtm . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 120.79 0.329 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.0 t -97.38 137.69 35.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.468 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -94.38 138.0 32.86 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.869 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -99.26 139.01 35.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.288 0.566 . . . . 0.0 111.711 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.2 t -118.25 128.29 75.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.428 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.1 mt -109.81 119.79 59.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.249 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.1 m -134.03 161.11 41.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.85 0.357 . . . . 0.0 111.244 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.2 mm -115.89 121.95 68.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.034 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.12 126.77 31.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.722 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -99.67 -10.6 21.76 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.563 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.3 m-90 -141.96 145.26 34.3 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.839 0.352 . . . . 0.0 110.462 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -72.53 122.64 21.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.627 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.402 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 55.8 t80 -127.71 139.03 52.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.723 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.3 m -103.14 134.47 46.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.001 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.43 142.26 39.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.965 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -88.75 -4.56 58.49 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -149.45 176.95 10.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.637 0.256 . . . . 0.0 110.662 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -75.78 -34.18 60.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.127 0.489 . . . . 0.0 110.694 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -62.45 -35.98 81.0 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.146 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.671 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 0.9 OUTLIER -81.7 178.61 8.23 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.469 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.2 mp -126.12 161.33 27.88 Favored 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 121.32 0.581 . . . . 0.0 112.093 -178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -90.53 148.1 22.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.162 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.402 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 40.2 pt -130.06 163.21 36.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.42 ' HG2' ' N ' ' A' ' 25' ' ' LYS . 86.4 tttt -117.72 164.54 14.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.991 0.424 . . . . 0.0 111.277 -178.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.422 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 11.0 ptpp? -63.31 -12.89 33.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -137.75 5.55 2.64 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -77.27 146.79 36.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.753 0.311 . . . . 0.0 110.599 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 86.3 mtm180 -94.96 119.64 33.83 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 120.979 0.418 . . . . 0.0 110.875 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.53 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.6 mm? -113.77 142.41 46.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.468 -179.183 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -103.32 109.63 21.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.695 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.6 mt -79.68 151.12 30.67 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.312 0.577 . . . . 0.0 111.67 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.52 HD11 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -114.99 -29.01 6.82 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.804 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -161.4 118.36 2.23 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.363 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.435 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.1 p-10 -110.33 2.89 19.38 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.6 m -63.58 -38.9 92.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.955 0.407 . . . . 0.0 111.367 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -82.8 159.49 22.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.675 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.08 -35.6 71.62 Favored 'General case' 0 C--O 1.23 0.065 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.443 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 45.1 m95 -94.85 132.05 40.08 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.435 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 40.1 m0 -105.9 132.47 51.97 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -177.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -86.87 131.96 33.96 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.53 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.6 p -140.7 159.56 24.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -177.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -123.79 141.78 51.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.568 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -110.38 162.26 14.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.588 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.36 -19.93 39.57 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.587 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.79 5.01 14.67 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.8 t30 71.88 26.4 2.96 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 110.886 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -112.47 133.98 54.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.127 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 73.5 p -124.58 148.1 48.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.901 0.381 . . . . 0.0 111.205 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.671 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -163.23 -178.67 37.17 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.628 -179.468 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -113.27 97.05 6.24 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.462 ' CG1' ' HB2' ' A' ' 20' ' ' GLU . 0.2 OUTLIER -112.97 121.11 39.13 Favored Pre-proline 0 C--N 1.329 -0.315 0 C-N-CA 121.341 -0.144 . . . . 0.0 110.753 178.288 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.443 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 96.0 Cg_endo -78.26 43.33 1.39 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.018 1.812 . . . . 0.0 111.697 177.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.01 87.84 0.75 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.868 0.366 . . . . 0.0 111.343 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -68.32 -11.63 59.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.524 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.563 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 98.7 m-85 -69.09 -10.47 57.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.3 p -114.86 141.49 31.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.996 0.427 . . . . 0.0 110.691 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -146.88 161.58 40.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.858 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.478 ' HG2' ' HG2' ' A' ' 59' ' ' LYS . 79.5 ttt-85 -69.84 138.84 52.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.881 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.478 ' HG2' ' HG2' ' A' ' 58' ' ' ARG . 74.6 mmtt . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.916 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.1 mtp . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 120.839 0.352 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 76.1 p -75.19 157.6 34.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.832 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -72.86 -27.77 62.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.025 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -103.98 128.39 51.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.831 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.2 t -107.86 132.28 55.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.472 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.0 mm -97.05 118.45 43.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.166 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 30.5 m -134.33 162.86 38.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.184 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 26.8 mm -120.96 130.38 74.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.035 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.18 150.92 38.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.844 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -117.09 -14.17 10.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.748 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 8.6 m-90 -148.69 149.98 32.4 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.93 0.395 . . . . 0.0 110.962 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -74.18 121.92 21.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.14 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -127.4 137.43 52.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.997 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.3 m -99.76 137.32 38.4 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.287 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.418 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -51.19 129.57 24.64 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.927 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -62.4 -23.74 67.0 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.985 0.422 . . . . 0.0 110.449 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -139.47 172.91 12.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.071 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -72.8 -29.39 63.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.926 0.393 . . . . 0.0 111.482 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -72.12 -17.46 61.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.911 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.514 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 1.0 OUTLIER -86.22 179.61 6.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.725 0.298 . . . . 0.0 110.327 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.3 tp -118.9 143.57 46.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.22 -179.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -86.0 151.66 23.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.654 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.4 HG23 HD11 ' A' ' 29' ' ' LEU . 33.7 pt -134.07 162.48 39.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.73 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -114.22 -176.95 3.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.195 0.522 . . . . 0.0 111.24 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -63.56 -52.95 58.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.427 -178.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -109.1 -0.17 19.55 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.414 ' HG2' HD22 ' A' ' 29' ' ' LEU . 66.6 tt0 -57.4 142.48 43.65 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.943 0.401 . . . . 0.0 111.404 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -94.7 122.29 37.16 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.343 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.478 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 3.8 mm? -111.38 145.43 38.9 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 26.6 m-90 -105.47 108.44 19.95 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.554 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.648 ' CD1' ' HD2' ' A' ' 34' ' ' ASP . 68.1 mt -72.16 147.42 46.63 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.071 0.463 . . . . 0.0 111.891 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.442 HD11 ' HA ' ' A' ' 41' ' ' VAL . 5.4 mp -112.6 -28.52 7.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.255 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -158.51 116.41 2.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.804 0.335 . . . . 0.0 111.101 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.648 ' HD2' ' CD1' ' A' ' 31' ' ' LEU . 96.4 m-20 -110.08 9.12 24.15 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.195 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 87.9 p -77.19 -35.13 56.06 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.923 0.392 . . . . 0.0 110.99 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -82.79 157.44 23.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.424 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -58.44 -36.78 74.18 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.438 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 15.2 m95 -95.51 130.17 42.44 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 177.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.428 ' CZ2' ' HB3' ' A' ' 34' ' ' ASP . 32.3 m0 -100.91 134.41 43.94 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.16 0.505 . . . . 0.0 112.277 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.407 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 73.5 ttt180 -92.79 133.06 36.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 177.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.478 ' CG2' ' HB3' ' A' ' 29' ' ' LEU . 1.2 p -140.48 147.05 23.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.929 -177.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.432 ' CB ' ' HB ' ' A' ' 48' ' ' THR . 58.8 ttt180 -118.54 153.3 34.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.653 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 53.4 p-10 -122.49 171.8 8.83 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.033 0.444 . . . . 0.0 111.808 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.36 -15.08 46.34 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.174 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.88 6.08 10.01 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 66.32 23.18 10.76 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.885 0.374 . . . . 0.0 111.269 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -119.53 129.41 54.67 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.432 ' HB ' ' CB ' ' A' ' 42' ' ' ARG . 5.7 t -135.99 155.85 49.63 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.684 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.514 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.81 -173.66 36.06 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 120.628 -0.796 . . . . 0.0 113.021 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 40' ' ' ARG . 98.1 m-85 -99.66 107.62 19.78 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 20.5 t -125.56 119.83 24.6 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.276 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.438 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 77.4 Cg_endo -83.21 39.63 0.84 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.217 1.945 . . . . 0.0 111.733 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.6 p -68.5 90.05 0.37 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.877 0.37 . . . . 0.0 111.617 -179.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -65.94 -13.59 60.04 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.45 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -60.22 -14.4 17.49 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.7 p -111.08 147.16 15.29 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 120.847 0.356 . . . . 0.0 110.759 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -146.07 164.9 30.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.64 -179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -68.4 141.86 55.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.332 . . . . 0.0 110.562 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.249 -0.881 . . . . 0.0 110.969 179.959 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.2 mtp . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.843 0.354 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.4 t 48.45 36.09 6.78 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.968 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -92.24 132.5 36.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 0.0 111.215 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -82.02 148.75 28.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.083 0.468 . . . . 0.0 111.0 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 68.5 t -115.05 130.25 69.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.698 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.4 mt -112.87 119.0 59.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.848 0.356 . . . . 0.0 111.403 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.2 m -132.68 161.65 41.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.07 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 30.7 mt -117.43 129.38 74.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.957 0.408 . . . . 0.0 111.339 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.85 148.29 38.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.362 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -113.31 -17.81 12.21 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.693 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.452 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.9 m-90 -143.62 134.54 25.4 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.965 0.412 . . . . 0.0 111.014 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -60.04 125.32 23.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.626 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -127.54 141.32 51.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.982 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 86.8 m -106.38 138.35 42.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.404 179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.453 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -55.92 132.27 49.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.728 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.474 ' HB2' ' HE2' ' A' ' 20' ' ' GLU . 97.4 mt-30 -66.79 -24.67 66.21 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.138 0.494 . . . . 0.0 110.58 179.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -136.12 170.67 15.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.103 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -72.46 -28.11 62.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.79 0.328 . . . . 0.0 111.168 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -69.96 -21.2 63.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.794 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.474 ' HE2' ' HB2' ' A' ' 16' ' ' GLN . 0.8 OUTLIER -82.9 -179.24 7.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.839 0.352 . . . . 0.0 110.556 179.901 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.7 tp -118.1 139.92 50.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.323 -178.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -83.54 140.67 32.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.422 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 32.3 pt -126.56 165.39 24.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.53 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.4 mttm -114.35 -178.68 3.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.12 0.486 . . . . 0.0 111.523 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -64.01 -52.14 60.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.396 -178.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -106.44 -6.42 18.21 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.78 146.75 30.36 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.918 0.39 . . . . 0.0 111.022 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.7 mtm105 -101.3 124.86 47.66 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.875 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.457 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 1.3 mm? -114.32 149.78 35.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.157 0.503 . . . . 0.0 111.644 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.2 m-90 -102.17 115.73 31.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.419 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.484 ' HA ' HG23 ' A' ' 41' ' ' VAL . 40.6 mt -79.88 146.22 32.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.367 0.603 . . . . 0.0 112.337 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.7 mt -108.94 -35.0 6.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.308 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.58 ' HD2' ' HB2' ' A' ' 35' ' ' SER . 53.1 t0 -159.61 117.59 2.73 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.11 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.419 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.8 p-10 -107.41 4.94 26.84 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.163 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.58 ' HB2' ' HD2' ' A' ' 33' ' ' ASP . 71.9 m -69.11 -36.56 77.67 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.776 0.322 . . . . 0.0 111.696 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -84.06 156.84 22.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.101 0.477 . . . . 0.0 112.035 -179.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 60.2 m -55.75 -31.29 62.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.368 177.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.2 m95 -101.59 134.25 45.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.427 ' CE3' HD22 ' A' ' 31' ' ' LEU . 37.5 m0 -103.82 138.01 41.02 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -97.13 130.45 44.39 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.484 HG23 ' HA ' ' A' ' 31' ' ' LEU . 0.5 OUTLIER -139.56 148.62 23.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 120.59 -0.444 . . . . 0.0 112.023 -177.73 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -122.99 146.53 47.54 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.886 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -113.44 171.2 7.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.038 0.447 . . . . 0.0 112.022 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.22 -16.2 31.37 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.991 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.61 5.04 16.61 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 69.93 22.09 6.0 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.75 0.309 . . . . 0.0 111.143 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -116.46 128.62 55.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.11 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.5 t -134.04 151.46 51.43 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.318 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.434 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -160.77 -173.43 29.36 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.807 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -100.06 104.55 16.13 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 111.106 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.3 t -123.88 112.29 28.84 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.023 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.8 44.34 1.27 Allowed 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 121.794 1.662 . . . . 0.0 111.437 177.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.9 p -72.92 81.97 1.2 Allowed 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 120.88 0.371 . . . . 0.0 111.467 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -64.76 -13.36 54.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.338 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.452 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.9 m-85 -62.94 -10.92 15.35 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.3 p -108.82 141.78 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-O 121.05 0.453 . . . . 0.0 111.033 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -130.17 158.46 39.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.651 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 24.3 ttm105 -70.22 129.65 39.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.925 0.393 . . . . 0.0 111.25 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.251 179.723 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.0 mtp . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.86 0.362 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.6 m -79.82 132.24 36.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.923 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -98.48 124.38 43.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.021 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -98.94 137.25 37.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.195 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.513 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 99.6 t -116.64 133.01 64.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.586 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mt -101.08 119.12 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.877 0.37 . . . . 0.0 111.235 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.96 163.03 38.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.545 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.438 HD11 ' HD2' ' A' ' 59' ' ' LYS . 47.3 mt -122.89 127.59 74.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.77 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.08 145.25 44.57 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.952 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -108.83 -18.01 13.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.887 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.516 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 9.7 m-90 -143.87 147.54 34.19 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.844 0.354 . . . . 0.0 111.595 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.453 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 60.5 t0 -69.89 123.14 20.73 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.179 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.404 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 65.1 t80 -128.52 134.88 48.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.666 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 92.6 m -99.5 140.97 32.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.413 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.463 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -53.37 131.49 37.87 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.599 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -67.41 -18.32 65.07 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.384 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -142.6 173.7 11.3 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -76.24 -22.27 55.36 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.678 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -82.11 -7.04 59.6 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.463 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 1.1 mt-10 -92.88 -179.96 5.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.92 0.39 . . . . 0.0 110.744 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.435 HD22 ' N ' ' A' ' 43' ' ' ASN . 46.3 tp -116.59 140.51 49.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.554 -178.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -85.62 150.06 24.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.837 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.404 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 31.2 pt -134.71 164.1 34.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.339 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -116.13 -175.87 2.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.916 0.389 . . . . 0.0 111.486 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.516 ' HD3' ' HA ' ' A' ' 11' ' ' TRP . 13.9 mmtt -64.67 -48.17 75.72 Favored 'General case' 0 C--N 1.334 -0.097 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -112.8 -4.72 13.96 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.424 ' HG2' HD21 ' A' ' 29' ' ' LEU . 73.0 tt0 -58.51 143.03 47.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.905 0.384 . . . . 0.0 111.422 -179.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.414 ' NE ' HD12 ' A' ' 8' ' ' ILE . 90.7 mtt180 -99.74 126.12 45.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.628 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.485 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.3 mm? -114.67 146.45 40.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.002 0.429 . . . . 0.0 111.731 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -103.5 107.03 17.7 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.268 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.513 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 66.3 mt -72.9 148.54 44.26 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.117 0.485 . . . . 0.0 111.652 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.524 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -111.97 -29.01 7.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.023 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -158.97 116.97 2.86 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.52 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.432 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 36.6 p-10 -111.26 9.31 21.71 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.2 p -70.28 -36.71 74.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.919 0.39 . . . . 0.0 111.181 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -85.13 155.93 21.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.557 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -35.39 61.36 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.5 m95 -95.62 135.34 37.43 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.432 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 41.9 m0 -109.13 133.17 53.36 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -177.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.434 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 46.4 ttt180 -87.53 134.44 33.61 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.524 ' HA ' HD13 ' A' ' 32' ' ' LEU . 1.5 p -145.78 157.35 12.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.824 -178.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -121.27 143.46 49.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.389 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.435 ' N ' HD22 ' A' ' 21' ' ' LEU . 54.3 t30 -113.49 161.74 16.99 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.372 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.94 -21.33 29.25 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.546 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.76 5.76 10.54 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.9 m120 68.54 23.73 7.24 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 120.841 0.353 . . . . 0.0 111.046 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -108.86 128.54 55.0 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.121 -0.491 . . . . 0.0 109.816 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 81.7 p -119.67 150.41 40.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.067 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.443 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -169.23 171.68 43.14 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.459 -0.876 . . . . 0.0 113.217 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.434 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.5 m-85 -102.68 106.37 17.0 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.574 0.225 . . . . 0.0 111.493 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.1 m -123.08 119.21 27.8 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.327 178.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -77.31 33.11 0.43 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.147 1.898 . . . . 0.0 112.067 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.8 p -59.1 100.78 0.08 Allowed 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.644 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -81.4 -4.65 56.39 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 177.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -72.65 -7.61 51.21 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.538 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.7 p -118.81 142.43 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 CA-C-O 120.936 0.398 . . . . 0.0 110.563 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -141.32 161.22 38.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.754 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -69.93 134.72 48.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.027 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.438 ' HD2' HD11 ' A' ' 8' ' ' ILE . 79.8 tttt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.791 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.2 mtm . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.883 0.373 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.1 p -75.99 156.34 34.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.05 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -95.43 131.11 41.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.928 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -100.89 140.3 35.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.069 0.461 . . . . 0.0 111.421 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.453 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.0 t -117.87 132.61 67.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.304 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mm -103.21 109.86 28.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.414 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.4 ' CG2' HG22 ' A' ' 56' ' ' VAL . 13.1 m -128.85 162.23 36.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.771 0.319 . . . . 0.0 111.444 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 22.8 mt -124.06 122.89 65.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.821 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.59 117.03 17.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.391 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -91.53 -5.35 54.27 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.538 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.2 m-90 -144.65 142.04 29.81 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.906 0.384 . . . . 0.0 110.528 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -70.09 120.39 15.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.584 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.418 ' CD1' ' HB2' ' A' ' 53' ' ' SER . 49.4 t80 -127.27 134.13 50.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.556 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.3 m -101.25 141.95 33.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.942 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.466 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.06 135.56 56.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.703 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -83.27 -4.52 58.51 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.074 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.04 168.47 19.93 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.071 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -73.82 -35.34 64.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.443 . . . . 0.0 112.171 -178.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -76.15 -9.72 58.85 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.346 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.703 ' HE2' ' HZ3' ' A' ' 38' ' ' TRP . 0.8 OUTLIER -82.4 -178.52 7.09 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.008 0.432 . . . . 0.0 110.855 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.478 HD22 HG11 ' A' ' 41' ' ' VAL . 8.9 tp -122.82 138.94 54.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.79 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -83.0 149.08 27.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.439 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.402 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 38.8 pt -134.22 160.8 41.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.332 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -116.0 168.16 10.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.09 0.471 . . . . 0.0 111.32 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.405 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 47.3 pttt -67.36 -11.43 57.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.055 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -141.11 27.24 1.97 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.156 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -102.44 135.64 43.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.791 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.6 mtt85 -86.66 119.96 27.46 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.02 0.438 . . . . 0.0 110.852 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.595 ' HB3' HG23 ' A' ' 41' ' ' VAL . 2.3 mm? -111.05 143.1 42.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.456 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.0 m-90 -104.32 105.28 15.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.325 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.453 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 25.3 mt -80.64 148.79 30.09 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.929 0.395 . . . . 0.0 111.091 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 41' ' ' VAL . 4.3 mp -110.19 -26.17 9.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.213 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -158.59 115.44 2.79 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.767 0.318 . . . . 0.0 111.042 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.405 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 31.9 p-10 -112.24 16.76 19.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.828 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.0 p -78.95 -36.68 41.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.988 0.423 . . . . 0.0 110.976 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -85.29 161.58 19.46 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.771 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 20.7 p -55.74 -41.03 73.34 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.703 ' HZ3' ' HE2' ' A' ' 20' ' ' GLU . 49.8 m95 -92.48 133.45 35.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.165 178.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.428 ' CE3' HD11 ' A' ' 31' ' ' LEU . 38.4 m0 -106.89 132.59 52.67 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -86.97 132.94 33.64 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.595 HG23 ' HB3' ' A' ' 29' ' ' LEU . 4.2 p -149.0 155.32 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -177.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -124.07 147.15 48.1 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.942 0.401 . . . . 0.0 111.691 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.412 ' HB2' HD21 ' A' ' 21' ' ' LEU . 39.7 t30 -111.19 164.69 12.61 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.699 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.78 -17.99 61.97 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.677 177.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.18 5.89 15.56 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.011 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 68.31 25.18 7.15 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.773 0.32 . . . . 0.0 111.713 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 82.1 mtt85 -111.56 128.72 56.12 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 178.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 77.8 p -117.42 153.87 32.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.967 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.473 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -171.87 168.83 41.96 Favored Glycine 0 CA--C 1.524 0.635 0 C-N-CA 120.512 -0.852 . . . . 0.0 113.567 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -103.33 105.91 16.3 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.1 m -127.19 112.85 21.56 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 111.604 0.224 . . . . 0.0 111.604 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.414 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 11.8 Cg_exo -71.16 36.23 0.29 Allowed 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 122.6 2.2 . . . . 0.0 112.683 178.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.418 ' HB2' ' CD1' ' A' ' 13' ' ' TYR . 41.8 t -67.0 93.45 0.28 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.022 0.439 . . . . 0.0 111.897 -178.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -71.07 -9.71 58.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.365 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.538 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.7 m-85 -64.38 -13.34 50.27 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.993 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.4 HG22 ' CG2' ' A' ' 7' ' ' VAL . 5.8 p -116.16 143.72 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.12 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -148.56 160.29 43.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.896 0.379 . . . . 0.0 111.357 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -72.27 134.81 45.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.4 mttt . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.522 179.134 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 120.84 0.353 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.0 t -94.2 -1.07 54.69 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.835 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -98.83 138.52 35.84 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.826 0.346 . . . . 0.0 111.069 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -101.09 139.64 36.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.243 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.479 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.0 t -109.52 127.68 66.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.358 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 8.1 mt -103.91 120.39 54.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.388 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 21.0 m -132.41 160.03 42.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.571 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.466 ' HA ' ' HA ' ' A' ' 28' ' ' ARG . 51.7 mt -117.82 122.75 70.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.08 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.84 122.2 23.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.139 0.495 . . . . 0.0 111.71 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -91.39 -2.81 57.21 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.38 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.538 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 8.4 m-90 -145.66 143.51 29.86 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.779 0.323 . . . . 0.0 110.949 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.9 p-10 -72.4 122.71 21.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.198 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.415 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 62.4 t80 -128.39 140.47 51.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.17 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.3 m -100.82 136.18 41.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.61 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.458 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -56.97 134.67 55.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.351 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -65.73 -34.33 77.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.086 0.469 . . . . 0.0 110.272 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -128.8 168.38 15.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.233 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -68.01 -34.34 76.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.978 0.418 . . . . 0.0 111.164 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -62.89 -26.26 68.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.085 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.458 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -80.64 -178.68 6.86 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.509 HD23 ' HB2' ' A' ' 43' ' ' ASN . 7.3 mp -124.62 145.52 49.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.587 -178.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -83.64 149.81 26.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.028 178.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.448 HD13 ' CB ' ' A' ' 53' ' ' SER . 43.8 pt -130.79 166.12 29.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.159 179.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -120.3 166.76 13.07 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.287 0.565 . . . . 0.0 110.962 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 21.2 pttp -66.61 -12.9 60.1 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.739 -179.256 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -135.4 22.07 3.42 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.208 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -101.08 143.42 31.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.875 0.369 . . . . 0.0 110.592 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.466 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 26.3 ptt85 -102.86 128.35 49.67 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.935 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.489 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 0.7 OUTLIER -115.81 151.76 34.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.189 -178.968 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 8.7 m-90 -100.51 110.63 22.81 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.046 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.487 ' HA ' HG21 ' A' ' 41' ' ' VAL . 86.7 mt -75.41 145.65 41.41 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.946 0.403 . . . . 0.0 111.573 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.407 HD11 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -111.69 -29.87 7.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.007 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.568 ' HD2' ' HB2' ' A' ' 35' ' ' SER . 54.2 t0 -161.02 119.86 2.53 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.863 0.363 . . . . 0.0 110.952 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.417 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.4 p-10 -106.44 1.97 26.0 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.568 ' HB2' ' HD2' ' A' ' 33' ' ' ASP . 73.3 m -64.9 -39.17 93.11 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -81.32 158.79 24.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.195 0.521 . . . . 0.0 112.192 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 94.2 m -58.64 -36.22 73.77 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.024 178.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.503 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 21.1 m95 -99.37 125.41 45.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.417 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 41.7 m0 -95.11 138.98 32.09 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -177.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 -92.8 136.27 33.39 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 177.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.489 ' CG2' ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -141.51 159.68 21.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.834 -178.325 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -121.6 145.06 48.36 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.242 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.509 ' HB2' HD23 ' A' ' 21' ' ' LEU . 52.0 t30 -111.0 162.76 14.53 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.934 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.12 -23.15 45.06 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.852 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.52 5.46 7.32 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 179.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.3 m120 71.33 26.6 3.3 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 120.874 0.369 . . . . 0.0 110.714 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 25.9 mmt85 -106.34 145.75 31.28 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.765 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.4 p -135.21 148.84 49.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.723 0.297 . . . . 0.0 111.135 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.15 -172.03 36.95 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.851 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -108.89 112.35 24.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.712 0.291 . . . . 0.0 111.419 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.09 113.3 21.74 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.416 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.503 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 59.9 Cg_endo -76.94 31.11 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.414 2.076 . . . . 0.0 112.484 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.448 ' CB ' HD13 ' A' ' 23' ' ' ILE . 13.8 p -62.43 87.24 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.772 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -72.86 -8.12 54.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.517 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.538 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 99.6 m-85 -71.79 -1.29 13.54 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.5 p -111.04 144.78 18.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-O 120.877 0.37 . . . . 0.0 110.922 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -136.03 148.79 48.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.988 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 78.2 ttt-85 -70.43 138.97 51.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.868 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 62.3 tttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.861 179.638 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.9 mtm . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.826 0.345 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.5 m -77.79 129.42 35.44 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.718 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -91.64 -3.14 56.69 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.798 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -94.33 139.67 30.79 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.165 0.507 . . . . 0.0 111.154 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.426 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.7 t -114.41 130.02 69.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.369 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.9 mt -104.5 121.08 55.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.842 0.353 . . . . 0.0 110.939 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 27.2 m -132.34 162.72 39.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.964 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 24.3 mt -116.76 128.46 74.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.642 179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.63 146.75 44.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.037 0.446 . . . . 0.0 111.119 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.9 mtpp -110.25 -21.9 12.01 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.328 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.498 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.9 m-90 -137.47 142.08 41.55 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.164 0.507 . . . . 0.0 110.975 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -65.37 127.1 30.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.535 -179.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.449 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 68.0 t80 -128.47 140.24 51.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.707 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.9 m -101.91 134.12 45.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.737 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.423 ' CB ' ' HG3' ' A' ' 20' ' ' GLU . . . -51.87 128.23 23.4 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.35 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -67.82 -24.26 65.27 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.953 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -146.42 171.47 14.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.919 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -67.19 -35.04 78.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.928 0.394 . . . . 0.0 111.585 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -58.17 -40.43 81.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.058 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.657 ' HE2' ' HZ3' ' A' ' 38' ' ' TRP . 5.5 pt-20 -83.41 -179.55 7.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.075 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.431 HD13 ' N ' ' A' ' 21' ' ' LEU . 8.6 mp -122.22 162.26 21.72 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -89.33 144.43 26.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.92 178.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.449 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 34.6 pt -128.95 163.98 32.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.405 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 96.4 mttt -111.94 -179.12 3.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.339 0.59 . . . . 0.0 111.442 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -61.8 -51.99 66.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.808 -179.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -105.82 -7.46 18.29 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 74.9 tt0 -54.03 145.2 17.29 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.036 0.446 . . . . 0.0 111.363 -179.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -101.95 125.87 48.73 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.531 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.5 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 1.0 OUTLIER -114.6 146.88 40.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.33 -179.165 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -100.91 111.65 23.9 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.172 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.649 HD11 ' HD2' ' A' ' 34' ' ' ASP . 83.0 mt -76.32 143.73 40.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.758 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.496 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -111.46 -28.25 8.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.909 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -160.97 120.31 2.61 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.116 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.649 ' HD2' HD11 ' A' ' 31' ' ' LEU . 94.4 m-20 -109.17 5.2 23.69 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.942 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 t -69.62 -35.98 75.74 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.846 0.355 . . . . 0.0 111.427 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -83.23 157.4 22.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.668 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 90.5 m -56.83 -35.78 69.21 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.657 ' HZ3' ' HE2' ' A' ' 20' ' ' GLU . 16.3 m95 -98.89 131.54 44.9 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.425 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 43.5 m0 -101.47 134.25 44.85 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.419 0.525 . . . . 0.0 112.419 -177.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.437 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 46.2 ttt85 -88.08 131.81 34.54 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.337 178.393 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.5 ' CG2' ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -133.31 163.4 37.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.601 -178.522 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -126.77 140.9 52.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.367 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -108.82 162.99 13.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.823 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.73 -22.75 58.45 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.551 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.76 4.45 9.6 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.9 t30 74.31 24.17 1.91 Allowed 'General case' 0 C--N 1.342 0.258 0 C-N-CA 122.505 0.322 . . . . 0.0 110.952 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -105.59 142.83 34.65 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.097 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 78.4 p -132.82 147.05 52.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.803 0.335 . . . . 0.0 111.277 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.456 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -170.31 176.83 43.83 Favored Glycine 0 CA--C 1.523 0.567 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.557 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.437 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 96.1 m-85 -103.13 99.39 9.26 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.075 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 19.8 t -108.1 111.83 61.78 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.294 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.86 32.93 0.33 Allowed 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.132 1.888 . . . . 0.0 112.448 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.8 p -65.04 91.69 0.1 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.793 0.33 . . . . 0.0 111.344 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -72.6 -7.4 50.03 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.971 178.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.498 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.4 m-85 -66.81 -10.22 45.48 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.861 0.465 . . . . 0.0 112.231 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.5 p -115.49 143.63 24.92 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.122 0 CA-C-O 121.025 0.441 . . . . 0.0 110.805 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.28 157.24 46.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.528 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 73.8 ttp85 -79.73 132.08 36.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.95 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.3 mtmm . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.316 -0.849 . . . . 0.0 110.891 179.832 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.8 mtt . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.662 0.267 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 71.5 p -89.12 -0.65 57.61 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.882 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -101.07 133.62 45.31 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-O 120.904 0.383 . . . . 0.0 111.221 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -98.82 138.67 35.63 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.766 179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.483 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 63.5 t -111.29 130.39 64.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.676 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.416 HD11 HG23 ' A' ' 6' ' ' ILE . 10.5 mt -104.07 121.0 55.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.286 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.44 ' CG1' ' HG2' ' A' ' 58' ' ' ARG . 22.2 m -132.55 162.35 39.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.809 0.338 . . . . 0.0 111.685 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.7 mt -123.62 120.61 60.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.85 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.6 129.24 37.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.643 -179.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -95.32 -6.57 40.93 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.367 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.479 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.1 m-90 -147.34 142.25 26.91 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.848 0.356 . . . . 0.0 110.85 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.43 122.25 20.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.42 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.404 ' CE1' ' O ' ' A' ' 14' ' ' THR . 60.2 t80 -127.46 138.37 52.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.511 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.404 ' O ' ' CE1' ' A' ' 13' ' ' TYR . 27.2 m -98.37 139.63 33.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.9 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.439 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -53.45 128.02 27.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.754 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -61.46 -33.0 73.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.204 0.526 . . . . 0.0 110.426 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -135.76 162.0 33.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.699 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -59.17 -35.69 73.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.918 0.39 . . . . 0.0 111.659 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -66.06 -20.29 66.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.6 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.439 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 2.3 mm-40 -81.74 -179.83 7.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.948 0.404 . . . . 0.0 110.259 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.402 HD23 ' CG1' ' A' ' 41' ' ' VAL . 9.2 tp -120.21 145.59 46.85 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.681 -178.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -86.71 146.35 26.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.575 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 29.5 pt -131.13 164.29 34.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.106 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -121.59 168.9 11.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.233 0.539 . . . . 0.0 111.067 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.471 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 53.9 pttt -67.1 -15.27 63.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.386 -0.824 . . . . 0.0 113.162 -178.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -139.01 23.61 2.59 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.534 -0.466 . . . . 0.0 111.213 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -99.85 139.1 36.0 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.113 0.482 . . . . 0.0 110.641 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 60.6 mtt85 -92.65 121.43 34.07 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.76 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.465 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 0.5 OUTLIER -113.92 150.07 34.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.875 0.369 . . . . 0.0 110.683 -179.607 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -102.71 113.53 27.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.404 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.483 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 61.0 mt -78.78 143.41 36.12 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.053 0.454 . . . . 0.0 111.28 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.488 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -107.82 -28.18 9.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.78 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.588 ' HD2' ' HB3' ' A' ' 35' ' ' SER . 52.9 t0 -159.1 117.05 2.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.947 0.403 . . . . 0.0 110.889 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.426 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.9 p-10 -107.0 1.61 24.53 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.047 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.588 ' HB3' ' HD2' ' A' ' 33' ' ' ASP . 32.5 t -67.13 -37.76 84.39 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.88 0.371 . . . . 0.0 111.517 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -81.06 159.51 24.74 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.67 0.748 . . . . 0.0 112.779 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 16.9 p -56.96 -39.9 75.47 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.255 178.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -97.15 132.67 42.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.79 -1.095 . . . . 0.0 108.366 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.426 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 36.1 m0 -102.2 136.66 41.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -177.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 44.2 ttt180 -93.49 137.78 32.43 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 177.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.488 ' HA ' HD13 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -142.37 162.53 18.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.701 -0.4 . . . . 0.0 111.263 -178.316 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -125.04 143.41 50.93 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.041 0.448 . . . . 0.0 111.891 -178.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -110.61 164.64 12.53 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.923 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.61 -22.97 64.34 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.804 178.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.97 5.33 11.91 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.043 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 67.82 26.56 7.63 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.95 0.405 . . . . 0.0 111.271 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 27.1 ttm180 -110.4 127.65 55.19 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 37.3 p -122.72 152.62 40.4 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.832 0.349 . . . . 0.0 110.997 -179.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -168.22 173.1 43.01 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.524 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -100.92 107.16 18.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.916 0.389 . . . . 0.0 111.17 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.3 t -119.75 113.91 34.39 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.058 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.08 42.81 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 121.804 1.669 . . . . 0.0 111.82 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.403 ' O ' HG13 ' A' ' 56' ' ' VAL . 2.8 p -70.62 88.45 0.69 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.096 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -66.54 -13.98 61.71 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.124 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.479 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.8 m-85 -61.67 -15.45 40.2 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 53' ' ' SER . 7.4 p -107.07 141.85 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 120.984 0.421 . . . . 0.0 110.451 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -127.44 151.35 48.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.768 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.44 ' HG2' ' CG1' ' A' ' 7' ' ' VAL . 76.4 mtp180 -69.57 139.9 53.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.836 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.1 pttm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.909 179.259 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.5 mtm . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 120.95 0.405 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.7 t -98.33 123.23 42.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.406 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -98.39 127.82 44.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.636 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -80.01 144.48 33.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.002 0.43 . . . . 0.0 110.953 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.427 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 77.9 t -116.13 133.88 61.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.949 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.5 mt -115.01 114.42 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.409 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 32.2 m -130.68 163.72 35.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.776 0.322 . . . . 0.0 111.55 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.7 mt -121.94 121.93 65.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.413 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.45 120.26 22.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.677 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -91.11 -7.71 50.88 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.562 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.606 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.8 m-90 -143.57 143.18 31.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.956 0.408 . . . . 0.0 110.705 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -72.08 120.47 17.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.129 0.49 . . . . 0.0 111.751 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.404 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 60.1 t80 -128.26 134.7 49.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.766 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.8 m -100.83 138.69 37.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.488 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.449 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -56.54 132.51 51.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.491 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.811 ' HB2' ' HE2' ' A' ' 20' ' ' GLU . 99.0 mm-40 -69.96 -16.06 63.14 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.998 179.191 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -141.64 172.89 12.06 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -74.38 -34.3 63.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.264 0.554 . . . . 0.0 110.533 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.77 -19.13 64.74 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.135 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.811 ' HE2' ' HB2' ' A' ' 16' ' ' GLN . 0.7 OUTLIER -86.4 -179.85 6.74 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.635 -179.264 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.412 ' CD2' ' HB2' ' A' ' 43' ' ' ASN . 28.6 tp -122.1 130.72 53.5 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -177.18 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -71.23 142.24 50.58 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.194 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.404 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 38.1 pt -129.03 164.48 31.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.374 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -120.98 167.02 13.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.227 0.537 . . . . 0.0 111.366 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.429 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 56.2 pttt -66.84 -12.91 60.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.334 -0.848 . . . . 0.0 113.101 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -141.52 28.35 1.82 Allowed 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -105.09 140.57 38.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.085 0.469 . . . . 0.0 110.928 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 -92.46 119.12 31.66 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.184 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.47 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.5 mm? -112.23 150.91 30.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.511 -179.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -107.2 106.49 16.99 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.612 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.485 ' HA ' HG22 ' A' ' 41' ' ' VAL . 39.3 mt -76.06 149.67 37.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.44 0.638 . . . . 0.0 111.334 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -112.19 -30.43 7.21 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.643 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.1 m-20 -157.04 113.91 3.05 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.529 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.431 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -106.49 2.47 26.29 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -65.18 -37.9 88.8 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 120.843 0.354 . . . . 0.0 111.308 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -82.58 158.21 23.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.545 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -34.59 69.6 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.383 0.611 . . . . 0.0 109.383 178.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.468 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 37.4 m95 -96.21 129.84 43.42 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 114.985 -1.007 . . . . 0.0 108.703 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.431 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 38.6 m0 -104.11 132.53 50.27 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -177.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.4 ' HB2' ' CE1' ' A' ' 50' ' ' TYR . 56.2 ttt180 -90.03 131.06 36.11 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 177.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 31' ' ' LEU . 0.7 OUTLIER -142.5 157.63 19.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.41 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -123.59 141.85 51.61 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.707 -179.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.412 ' HB2' ' CD2' ' A' ' 21' ' ' LEU . 51.7 t30 -113.15 162.45 15.95 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.016 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.03 -18.91 15.85 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.882 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.71 5.27 11.56 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 67.39 26.05 8.49 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-O 120.852 0.358 . . . . 0.0 111.065 -179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -115.25 125.81 53.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.812 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.3 p -116.81 151.44 36.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.878 0.371 . . . . 0.0 111.032 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.513 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.25 168.38 38.63 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.197 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.4 ' CE1' ' HB2' ' A' ' 40' ' ' ARG . 96.7 m-85 -102.37 102.65 13.01 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.3 m -120.08 122.99 28.59 Favored Pre-proline 0 C--N 1.325 -0.479 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.729 178.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.468 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 84.2 Cg_endo -80.62 29.28 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.25 1.967 . . . . 0.0 112.333 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.66 91.89 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.3 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -68.96 -12.7 61.9 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.059 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.606 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 99.1 m-85 -63.8 -13.79 47.31 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.424 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -113.39 142.4 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-O 121.023 0.44 . . . . 0.0 110.579 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -140.61 157.87 44.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.522 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -69.67 137.74 52.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.9 0.381 . . . . 0.0 110.804 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.4 tttt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.802 -179.78 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.5 mtp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.822 0.344 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 80.5 p -73.49 154.79 39.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.06 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -92.19 136.48 33.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.001 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -98.44 139.95 33.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.034 0.445 . . . . 0.0 111.112 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.7 t -114.88 128.28 72.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.891 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.5 mt -104.28 116.26 47.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.911 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.421 ' HA ' ' HA ' ' A' ' 58' ' ' ARG . 26.4 m -130.83 163.07 37.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.983 0.42 . . . . 0.0 111.653 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 13.9 mt -123.65 133.49 69.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.019 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -80.33 137.01 36.51 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.675 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -102.74 7.45 39.66 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.66 ' CE3' ' HB2' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -163.06 151.18 13.78 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.805 0.336 . . . . 0.0 110.506 178.726 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.409 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 43.3 t0 -79.11 113.68 17.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.031 0.444 . . . . 0.0 111.91 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.469 ' HB2' ' CE2' ' A' ' 11' ' ' TRP . 56.4 t80 -127.57 145.79 50.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.16 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.9 t -105.75 135.22 47.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.373 178.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.432 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -52.75 139.24 27.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.476 . . . . 0.0 112.025 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -64.52 -31.34 72.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.071 0.463 . . . . 0.0 109.817 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -136.73 165.29 26.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.614 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -62.91 -27.89 69.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.861 0.362 . . . . 0.0 110.97 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -68.05 -26.21 65.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.14 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.48 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 0.3 OUTLIER -89.08 176.92 6.79 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.7 mp -128.01 141.55 51.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.999 0.428 . . . . 0.0 111.275 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.0 p-10 -79.17 157.81 27.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.36 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 44.5 pt -127.93 155.48 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.028 179.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 12' ' ' ASP . 95.4 mttt -111.25 172.45 6.87 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.845 0.355 . . . . 0.0 111.049 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 19.5 pttp -68.01 -12.96 61.77 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -178.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -151.97 29.38 0.58 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.477 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.445 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 59.2 tt0 -98.77 142.06 30.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.84 0.352 . . . . 0.0 110.961 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 35.5 mtm-85 -92.3 121.59 33.95 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.404 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.445 ' CD2' ' HG2' ' A' ' 27' ' ' GLU . 0.6 OUTLIER -116.09 149.02 39.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.713 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -100.42 107.25 18.95 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.964 0.411 . . . . 0.0 110.743 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.436 HD23 ' CE3' ' A' ' 39' ' ' TRP . 0.1 OUTLIER -86.48 152.02 23.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.309 0.576 . . . . 0.0 112.444 -178.651 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 mp -114.0 -22.38 10.1 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.395 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -163.05 120.61 1.94 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.822 0.344 . . . . 0.0 110.815 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.415 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 30.1 p-10 -117.26 19.38 14.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.1 t -81.57 -34.99 30.71 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.741 0.305 . . . . 0.0 111.368 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.4 mmtm -86.87 160.9 18.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.925 0.393 . . . . 0.0 111.624 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 28.8 m -57.09 -33.98 67.85 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 121.352 0.596 . . . . 0.0 109.654 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.436 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 17.5 m95 -99.31 126.38 45.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.436 ' CE3' HD23 ' A' ' 31' ' ' LEU . 37.7 m0 -99.1 132.06 44.68 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.42 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 35.1 ttt180 -88.02 125.78 34.73 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.438 HG23 ' HB3' ' A' ' 29' ' ' LEU . 2.8 p -136.9 162.12 34.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -177.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -130.38 148.44 52.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.15 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -117.0 171.52 7.86 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.135 0.493 . . . . 0.0 112.034 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.2 -18.21 60.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.869 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.81 6.47 10.91 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 67.63 24.1 8.59 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 120.899 0.381 . . . . 0.0 111.14 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -111.03 128.37 55.84 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.861 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 16.5 p -113.66 159.11 20.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.513 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.48 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -175.1 176.75 47.21 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.18 -1.009 . . . . 0.0 113.347 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.42 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 65.2 m-85 -115.99 110.51 19.04 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -122.99 127.68 25.61 Favored Pre-proline 0 CA--C 1.532 0.251 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.618 178.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.436 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 76.7 Cg_endo -76.43 58.6 5.84 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.114 1.876 . . . . 0.0 111.765 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.3 p -66.97 94.36 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -60.42 -60.55 3.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.05 0.452 . . . . 0.0 109.951 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.66 ' HB2' ' CE3' ' A' ' 11' ' ' TRP . 19.5 m-85 -84.35 97.39 9.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 122.582 1.182 . . . . 0.0 113.431 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.426 HG13 ' CZ3' ' A' ' 39' ' ' TRP . 7.1 p -155.45 140.84 10.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.698 177.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -121.43 134.7 55.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.832 0.349 . . . . 0.0 111.679 -178.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 67.9 ttp85 -78.56 133.42 37.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.867 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.1 mttm . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.007 179.99 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mtm . . . . . 0 N--CA 1.488 1.449 0 CA-C-O 120.832 0.348 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 81.1 p -89.8 0.4 57.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.729 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -66.53 -33.32 75.43 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-O 121.079 0.466 . . . . 0.0 110.989 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.44 137.48 39.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.122 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 57.3 t -114.6 130.05 69.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.482 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 8.2 mt -106.14 116.71 50.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.766 0.317 . . . . 0.0 111.297 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.8 m -131.33 161.21 41.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.215 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.9 mt -122.41 126.3 73.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.78 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.77 144.94 41.13 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.941 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -110.14 -25.68 10.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.335 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.474 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 8.3 m-90 -133.36 137.63 45.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -61.98 122.05 14.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.621 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.425 ' CD1' ' HB2' ' A' ' 53' ' ' SER . 53.2 t80 -127.09 137.35 53.0 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.648 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.7 m -105.94 137.67 43.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.553 179.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.44 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -53.4 142.58 21.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.218 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -88.24 -8.31 55.46 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.272 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -149.12 167.54 25.65 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.646 0.26 . . . . 0.0 110.508 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -68.14 -29.27 68.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.335 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -77.22 -11.33 59.81 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.863 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.457 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -89.69 179.26 6.06 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 44.0 tp -121.7 134.63 54.96 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.026 0.441 . . . . 0.0 111.71 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -77.11 144.47 38.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.853 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 23.1 pt -131.83 164.66 34.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.109 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -113.13 -177.03 3.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.952 0.406 . . . . 0.0 111.284 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -64.91 -51.49 61.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.586 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -109.83 -5.6 15.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -57.05 144.63 33.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.813 0.34 . . . . 0.0 111.25 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.8 mtm180 -97.63 124.35 41.88 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.63 179.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.475 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 1.8 mm? -111.59 147.13 36.12 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.895 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.2 m-90 -104.33 104.24 14.1 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.144 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.923 ' HG ' ' HD2' ' A' ' 34' ' ' ASP . 0.5 OUTLIER -72.23 147.63 46.3 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.3 0.572 . . . . 0.0 112.259 -179.057 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.2 mp -109.82 -26.68 9.68 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.976 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.66 ' HD2' ' HB2' ' A' ' 35' ' ' SER . 58.4 t0 -160.99 118.16 2.33 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.808 0.337 . . . . 0.0 111.257 -179.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.923 ' HD2' ' HG ' ' A' ' 31' ' ' LEU . 97.0 m-20 -105.61 3.62 29.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.159 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.66 ' HB2' ' HD2' ' A' ' 33' ' ' ASP . 57.7 m -68.57 -35.36 77.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.708 0.289 . . . . 0.0 111.721 -179.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -85.68 156.48 20.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.257 0.551 . . . . 0.0 112.264 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 58.6 m -57.72 -31.8 66.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.188 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.461 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 7.4 m0 -100.26 132.99 45.32 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.417 ' HB3' ' CD1' ' A' ' 31' ' ' LEU . 23.5 m0 -100.69 128.97 46.55 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -176.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.414 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 72.6 ttt180 -87.94 122.82 32.01 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.084 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -138.45 151.09 24.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 120.475 -0.49 . . . . 0.0 112.219 -177.835 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.484 ' CB ' ' HB ' ' A' ' 48' ' ' THR . 24.4 ttp-105 -121.92 146.72 46.85 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.3 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -116.05 164.6 14.22 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.363 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.38 -18.26 16.72 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.867 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.89 4.78 11.11 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.3 t30 72.64 21.59 3.48 Favored 'General case' 0 C--N 1.339 0.116 0 CA-C-O 120.859 0.361 . . . . 0.0 111.302 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -114.8 130.49 56.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.905 179.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.484 ' HB ' ' CB ' ' A' ' 42' ' ' ARG . 12.2 t -141.34 143.17 33.87 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.778 -179.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.457 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.47 178.64 39.64 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.371 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.414 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.4 m-85 -93.38 113.17 25.28 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.632 0.253 . . . . 0.0 111.512 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.439 ' C ' ' H ' ' A' ' 53' ' ' SER . 4.6 m -127.46 120.94 22.21 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.846 -0.161 . . . . 0.0 111.263 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.461 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 6.3 Cg_exo -72.33 30.92 0.27 Allowed 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.421 2.081 . . . . 0.0 112.091 177.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.439 ' H ' ' C ' ' A' ' 51' ' ' VAL . 8.4 t -66.0 85.51 0.09 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 120.897 0.379 . . . . 0.0 111.135 -179.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 p30 -69.09 -9.97 55.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.422 178.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.474 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 80.9 m-85 -65.2 -10.63 33.03 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.6 p -115.03 141.48 31.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.909 0.385 . . . . 0.0 110.735 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -137.73 150.4 47.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.725 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -69.53 140.5 53.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.802 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 93.2 mttt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.243 -0.884 . . . . 0.0 111.051 179.968 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.3 mmm . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 120.72 0.295 . . . . 0.0 111.362 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m 57.79 22.23 8.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.227 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -91.33 -9.53 44.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.938 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 85.4 tt0 -69.81 138.95 53.09 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.139 0.495 . . . . 0.0 110.562 179.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.3 t -110.9 121.83 64.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.008 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.1 mt -114.06 118.38 58.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.117 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.443 ' CG1' ' HG2' ' A' ' 58' ' ' ARG . 32.9 m -131.39 162.53 39.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 121.048 0.452 . . . . 0.0 111.623 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 10.5 mt -120.02 123.6 71.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.503 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' A' ' 24' ' ' LYS . . . -75.5 126.5 31.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.202 -179.437 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -96.47 -10.35 27.65 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.336 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.604 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.6 m-90 -145.12 143.14 30.22 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.792 0.329 . . . . 0.0 110.577 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -67.8 125.51 26.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.096 0.474 . . . . 0.0 111.62 -178.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.448 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 58.2 t80 -127.8 138.12 52.62 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.844 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.7 t -102.74 140.28 37.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.913 0.387 . . . . 0.0 110.714 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.463 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -61.45 136.24 57.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.474 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -84.39 -3.58 58.39 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.085 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.463 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 92.8 mt-30 -145.47 171.65 14.33 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.586 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -76.44 -29.84 57.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.935 0.398 . . . . 0.0 111.283 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -75.99 -12.65 60.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.937 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.535 ' HB3' HG12 ' A' ' 51' ' ' VAL . 0.5 OUTLIER -88.74 178.02 6.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.933 0.397 . . . . 0.0 110.726 -179.697 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.511 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.5 mp -124.88 139.52 53.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.77 -178.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -78.6 146.41 34.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.354 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.448 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 45.8 pt -129.84 161.87 38.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.473 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.53 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 99.8 mttt -114.72 166.32 11.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.768 0.318 . . . . 0.0 111.025 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.46 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 21.0 pttp -63.75 -11.32 25.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -138.45 25.95 2.62 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.289 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.445 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 83.9 tt0 -99.57 138.01 37.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.854 0.359 . . . . 0.0 110.903 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -94.1 120.67 34.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.124 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.497 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -115.21 150.06 36.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.04 -179.351 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.0 m-90 -103.43 107.15 17.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.172 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.453 ' HA ' HG22 ' A' ' 41' ' ' VAL . 89.3 mt -76.69 149.15 36.44 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.051 0.453 . . . . 0.0 111.561 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.0 mp -113.97 -28.63 7.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.036 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -160.99 118.88 2.4 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.552 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 31.3 p-10 -110.87 2.8 18.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.128 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.0 m -65.06 -36.82 85.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.828 0.347 . . . . 0.0 111.342 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -83.63 158.75 21.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.083 0.468 . . . . 0.0 111.809 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.7 m -57.44 -34.78 69.32 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.552 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 61.3 m95 -97.64 131.61 44.06 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 177.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.469 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 40.5 m0 -103.94 133.79 48.31 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -177.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.423 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 37.4 ttt180 -88.58 130.1 35.33 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.525 ' HA ' HD13 ' A' ' 32' ' ' LEU . 0.7 OUTLIER -141.04 155.52 21.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 120.915 0.388 . . . . 0.0 111.589 -178.702 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -120.42 145.58 47.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.605 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -113.04 162.56 15.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.703 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.16 -21.33 46.7 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.879 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.34 5.23 10.96 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.857 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.0 t30 72.81 24.68 2.63 Favored 'General case' 0 N--CA 1.46 0.071 0 CA-C-O 120.829 0.347 . . . . 0.0 110.895 -179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.408 ' CB ' HD22 ' A' ' 21' ' ' LEU . 82.5 mtm180 -108.92 136.89 47.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.434 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 74.8 p -124.81 152.7 43.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.729 0.299 . . . . 0.0 110.905 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -174.23 179.87 45.3 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.56 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 95.3 m-85 -110.11 113.54 26.32 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.808 0.304 . . . . 0.0 111.618 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.535 HG12 ' HB3' ' A' ' 20' ' ' GLU . 29.4 m -131.21 112.02 15.59 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.587 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.552 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 74.0 Cg_endo -74.73 45.24 1.25 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.18 1.92 . . . . 0.0 111.855 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.429 ' HB3' ' CD1' ' A' ' 13' ' ' TYR . 1.4 p -69.61 73.63 0.38 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.038 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -53.57 -19.18 3.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.935 0.398 . . . . 0.0 110.93 178.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.604 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 77.5 m-85 -61.11 -12.83 13.66 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.221 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.416 ' CG2' ' HA ' ' A' ' 9' ' ' ALA . 11.9 p -110.36 146.15 15.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-O 120.808 0.337 . . . . 0.0 110.943 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.402 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 85.5 tt0 -142.21 164.17 30.88 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.544 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.443 ' HG2' ' CG1' ' A' ' 7' ' ' VAL . 18.8 mtp180 -68.69 139.28 55.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.528 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.6 tttp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.343 -0.836 . . . . 0.0 110.864 179.938 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.3 mtp . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 120.777 0.322 . . . . 0.0 110.942 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.0 t -99.58 119.96 38.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.22 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -96.68 138.14 34.7 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.86 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -98.99 138.68 35.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.159 0.504 . . . . 0.0 111.378 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 31' ' ' LEU . 64.1 t -119.84 131.91 71.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.382 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.3 mm -100.41 110.97 28.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.807 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.6 m -128.49 155.91 40.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.767 0.318 . . . . 0.0 111.348 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 30.6 mm -121.29 126.98 75.68 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.874 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.96 143.14 45.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.496 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -112.42 -24.34 9.8 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.753 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.578 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.3 m-90 -137.1 136.7 38.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.045 0.45 . . . . 0.0 110.552 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -59.74 120.8 10.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.394 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.424 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 49.3 t80 -127.22 138.39 53.1 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.144 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 86.6 m -107.06 139.64 41.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.657 179.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.429 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.22 135.54 56.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.713 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -87.75 0.32 55.9 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.542 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.457 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 95.8 mt-30 -147.11 167.23 24.63 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -75.05 -20.28 59.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.577 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -88.47 -8.19 55.32 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.457 ' CG ' ' HB2' ' A' ' 17' ' ' GLN . 0.7 OUTLIER -88.54 177.53 6.76 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.658 -179.757 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.422 ' H ' HG11 ' A' ' 51' ' ' VAL . 38.6 tp -119.44 128.66 54.23 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -70.4 141.69 52.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.9 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.402 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 35.9 pt -130.65 162.59 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.253 179.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.411 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 88.3 mttt -110.95 -177.27 3.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.901 0.381 . . . . 0.0 110.767 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HG3' ' HA ' ' A' ' 11' ' ' TRP . 27.6 ttpp -65.3 -48.76 72.01 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.626 -178.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -114.61 -0.25 13.71 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.411 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 66.3 tt0 -57.62 144.11 38.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.105 0.479 . . . . 0.0 111.175 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -91.49 121.67 33.39 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.467 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.637 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.7 mm? -115.28 140.65 48.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.344 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -100.89 105.26 16.51 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.793 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.671 HD12 ' HB3' ' A' ' 39' ' ' TRP . 5.6 tp -84.1 151.34 24.99 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.401 HD11 ' HA ' ' A' ' 41' ' ' VAL . 3.6 mp -107.92 -19.32 13.56 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.757 178.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -168.82 125.12 0.95 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.787 0.327 . . . . 0.0 111.326 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -115.58 2.18 13.73 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.682 179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.2 m -64.13 -38.33 90.65 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.791 0.329 . . . . 0.0 111.623 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -82.9 159.01 22.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.002 0.429 . . . . 0.0 111.746 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.8 m -58.94 -35.58 73.36 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.47 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 22.6 m95 -94.59 127.67 40.69 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.671 ' HB3' HD12 ' A' ' 31' ' ' LEU . 41.5 m0 -102.06 134.45 45.27 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -177.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.455 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 53.6 ttt180 -92.38 125.81 37.19 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.931 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.637 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -139.2 161.79 28.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -178.514 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -125.81 147.58 49.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.042 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.416 ' HB3' ' CD2' ' A' ' 21' ' ' LEU . 47.3 p-10 -118.6 172.25 7.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.012 0.434 . . . . 0.0 111.762 -179.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.37 -23.43 65.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.541 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.36 4.97 9.57 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 68.98 25.68 5.89 Favored 'General case' 0 N--CA 1.457 -0.093 0 CA-C-O 120.815 0.34 . . . . 0.0 111.012 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 55.3 mtp180 -111.09 132.46 54.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.692 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 80.6 p -123.49 148.28 46.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.923 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.453 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.2 168.69 40.58 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.39 -0.909 . . . . 0.0 113.142 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.455 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 96.9 m-85 -101.14 103.91 14.98 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.422 HG11 ' H ' ' A' ' 21' ' ' LEU . 4.7 m -117.4 119.93 33.91 Favored Pre-proline 0 C--N 1.33 -0.26 0 C-N-CA 121.214 -0.194 . . . . 0.0 111.385 178.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.47 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 72.6 Cg_endo -74.84 41.63 0.75 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.356 2.038 . . . . 0.0 111.6 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.435 ' O ' HG12 ' A' ' 56' ' ' VAL . 80.2 p -71.07 89.93 0.83 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.586 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -66.44 -13.23 60.48 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.589 -0.445 . . . . 0.0 110.166 178.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.578 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.5 m-85 -64.11 -12.96 44.29 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.435 HG12 ' O ' ' A' ' 53' ' ' SER . 9.4 p -114.6 140.9 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 121.129 0.49 . . . . 0.0 110.848 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -133.78 163.25 29.89 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.418 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 71.6 ttt-85 -80.21 135.74 36.33 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.47 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.684 179.786 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mtp . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.876 0.37 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.2 p -78.6 148.44 33.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.979 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -91.7 -4.5 55.03 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.687 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -98.76 139.14 34.9 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 121.001 0.429 . . . . 0.0 111.308 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.421 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.7 t -117.25 129.93 72.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.402 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -98.67 112.32 30.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.352 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 35.4 m -131.58 162.28 39.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.045 0.45 . . . . 0.0 111.835 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.42 HD13 HG21 ' A' ' 8' ' ' ILE . 33.5 mt -120.18 124.58 72.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.851 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.61 120.43 20.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.061 0.458 . . . . 0.0 111.481 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -92.96 -9.49 39.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.842 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.609 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.3 m-90 -141.86 142.24 33.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.87 0.366 . . . . 0.0 110.85 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -72.43 123.15 22.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.462 -179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.425 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 57.8 t80 -127.53 137.77 52.72 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.53 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.01 135.13 41.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.421 ' CB ' ' HG3' ' A' ' 20' ' ' GLU . . . -61.91 136.84 58.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.032 0.444 . . . . 0.0 111.795 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -86.53 0.14 54.91 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.313 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.45 ' HB2' ' HG2' ' A' ' 20' ' ' GLU . 96.7 mt-30 -153.69 162.0 41.64 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.914 0.387 . . . . 0.0 110.992 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -64.75 -40.21 94.93 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.242 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -61.01 -31.3 70.92 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.918 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.657 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 6.1 pt-20 -86.47 175.5 8.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.12 -179.417 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.455 HD22 ' CB ' ' A' ' 47' ' ' ARG . 10.6 mp -128.88 158.88 37.52 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -176.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -86.97 149.67 24.61 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.884 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 47.6 pt -130.68 161.05 41.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.798 178.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -115.9 166.54 11.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.253 0.549 . . . . 0.0 111.437 -179.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.452 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 54.9 pttt -66.37 -11.24 50.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.781 -179.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -140.54 25.35 2.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.406 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -100.94 140.0 35.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.101 0.477 . . . . 0.0 110.69 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 -91.69 119.57 31.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.824 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.473 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.2 mm? -110.55 143.59 40.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.419 -178.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 29.4 m-90 -98.78 106.01 18.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.985 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.431 ' HA ' HG22 ' A' ' 41' ' ' VAL . 73.0 mt -75.64 148.77 38.48 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.489 0.662 . . . . 0.0 111.823 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.504 ' N ' HD23 ' A' ' 32' ' ' LEU . 3.6 mm? -115.27 -35.52 4.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.896 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.411 ' HD2' ' HB3' ' A' ' 35' ' ' SER . 57.0 t0 -160.68 116.96 2.31 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.753 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -109.99 3.81 20.79 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.411 ' HB3' ' HD2' ' A' ' 33' ' ' ASP . 35.0 t -66.63 -39.24 88.19 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.799 0.333 . . . . 0.0 111.289 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -82.66 159.15 22.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.641 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.0 -34.75 68.46 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 121.417 0.627 . . . . 0.0 109.38 178.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.461 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 63.4 m95 -96.18 130.03 43.34 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.44 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 39.6 m0 -104.4 127.3 52.06 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.44 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 66.8 ttt180 -84.9 126.88 33.86 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.478 ' HA ' HD23 ' A' ' 32' ' ' LEU . 0.8 OUTLIER -134.69 161.92 39.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.102 0.477 . . . . 0.0 111.87 -178.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.402 ' CB ' HG23 ' A' ' 48' ' ' THR . 41.6 ttm180 -123.66 151.31 43.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.891 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.418 ' ND2' HD23 ' A' ' 21' ' ' LEU . 34.0 m-20 -119.68 168.57 10.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.813 0.34 . . . . 0.0 111.246 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.19 67.73 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.382 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.86 4.56 9.52 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.1 t30 72.44 24.06 3.02 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.819 0.343 . . . . 0.0 111.093 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.455 ' CB ' HD22 ' A' ' 21' ' ' LEU . 81.2 mtp180 -106.09 135.5 47.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.402 HG23 ' CB ' ' A' ' 42' ' ' ARG . 77.0 p -124.66 157.58 35.21 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.21 -179.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.657 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -174.02 174.27 46.25 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 120.303 -0.951 . . . . 0.0 113.105 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.44 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.7 m-85 -107.2 97.0 6.82 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -178.54 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.414 ' CG1' ' HB2' ' A' ' 20' ' ' GLU . 0.8 OUTLIER -115.26 116.91 41.66 Favored Pre-proline 0 N--CA 1.469 0.51 0 CA-C-O 119.622 -0.228 . . . . 0.0 111.361 177.839 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.461 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 73.9 Cg_endo -76.63 44.4 1.4 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.243 1.962 . . . . 0.0 111.464 177.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.516 ' O ' HG13 ' A' ' 56' ' ' VAL . 0.8 OUTLIER -70.26 80.08 0.53 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -59.49 -17.28 30.37 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.554 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.609 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 85.7 m-85 -59.82 -12.51 7.57 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.516 HG13 ' O ' ' A' ' 53' ' ' SER . 8.6 p -109.6 143.73 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 120.939 0.399 . . . . 0.0 110.96 179.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 55.6 mp0 -143.38 161.22 38.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.583 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -71.01 140.51 50.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.125 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.4 tttt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.753 179.312 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mtm . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.734 0.302 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.3 p -75.64 155.92 35.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.948 0.404 . . . . 0.0 111.124 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -97.75 119.34 36.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.915 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -102.75 139.23 38.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.407 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 30' ' ' TRP . 93.2 t -115.61 133.25 62.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.184 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.406 HG12 ' CD1' ' A' ' 30' ' ' TRP . 41.5 mt -114.49 115.88 50.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.771 0.32 . . . . 0.0 110.847 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.9 m -130.77 159.68 42.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.129 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 16.4 mm -114.93 125.71 72.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.59 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.05 145.17 42.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.802 0.334 . . . . 0.0 110.862 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -112.75 -23.7 10.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.477 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.547 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.8 m-90 -134.21 139.76 46.02 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.975 0.417 . . . . 0.0 110.593 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -66.68 121.22 14.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.282 -178.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.426 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 47.3 t80 -126.25 136.56 52.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.694 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.5 m -103.34 145.56 29.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.841 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.426 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.28 138.92 54.18 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.276 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -84.54 -9.3 58.45 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.975 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.404 ' HB2' ' HG2' ' A' ' 20' ' ' GLU . 74.9 mt-30 -150.75 168.78 23.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.235 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -67.08 -34.0 76.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.893 0.378 . . . . 0.0 111.64 -179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -77.66 -6.03 52.45 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.019 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.689 ' HB3' HG12 ' A' ' 51' ' ' VAL . 0.5 OUTLIER -87.74 179.04 6.57 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.801 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.471 ' O ' HG11 ' A' ' 51' ' ' VAL . 43.7 tp -121.32 119.12 31.27 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -68.32 141.47 55.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.266 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.488 HG21 ' CD1' ' A' ' 29' ' ' LEU . 14.9 pt -128.14 165.52 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.981 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.441 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 60.2 mttt -114.09 -179.12 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.215 0.531 . . . . 0.0 111.057 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.411 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 36.5 ttpt -64.53 -48.14 76.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.804 -178.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -113.09 2.57 15.74 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.441 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 71.3 tt0 -60.53 148.19 38.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.122 0.487 . . . . 0.0 111.363 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -94.54 121.32 35.96 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.946 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.654 ' HB3' HG22 ' A' ' 41' ' ' VAL . 3.6 mm? -114.58 137.79 51.45 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.433 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 6.3 m0 -101.3 106.01 17.15 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.982 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.419 ' O ' ' HB ' ' A' ' 5' ' ' VAL . 81.3 mt -78.58 154.53 30.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.488 0.661 . . . . 0.0 111.94 -179.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.476 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.0 mp -117.09 -29.19 6.01 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.808 179.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -158.98 116.65 2.82 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.203 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.465 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 40.2 p-10 -111.14 10.45 21.91 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.5 t -74.2 -35.24 63.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.878 0.371 . . . . 0.0 111.432 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmtp -84.4 159.62 20.79 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.794 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 87.9 m -59.27 -32.97 70.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.422 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.451 ' CD1' ' N ' ' A' ' 38' ' ' TRP . 2.8 m95 -96.74 130.95 43.89 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.465 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 32.5 m0 -103.36 135.85 44.22 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -177.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.41 ' HG2' HD11 ' A' ' 32' ' ' LEU . 28.3 ttm180 -96.7 127.86 43.09 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.654 HG22 ' HB3' ' A' ' 29' ' ' LEU . 3.8 p -143.55 156.62 16.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.962 -177.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -122.84 143.18 50.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.049 0.452 . . . . 0.0 111.68 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 -107.37 161.67 14.6 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.236 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.98 -24.28 64.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.197 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.67 2.64 11.46 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.357 -0.383 . . . . 0.0 112.032 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.2 t30 73.93 24.38 2.07 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.678 0.275 . . . . 0.0 111.042 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -109.39 129.71 55.53 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.308 -0.406 . . . . 0.0 109.956 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.1 p -125.15 161.58 26.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.694 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 178.6 169.73 39.71 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.997 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -97.49 108.76 21.54 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.788 0.328 . . . . 0.0 111.689 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.689 HG12 ' HB3' ' A' ' 20' ' ' GLU . 9.6 m -132.3 114.17 14.69 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.64 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -70.77 44.5 0.51 Allowed 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 121.858 1.706 . . . . 0.0 111.761 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 85.6 p -70.57 76.91 0.58 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 121.045 0.45 . . . . 0.0 110.506 -179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -60.14 -17.97 44.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.638 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.547 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 83.0 m-85 -58.86 -15.5 12.87 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.5 p -112.95 141.12 29.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-O 121.001 0.429 . . . . 0.0 110.676 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -142.96 162.57 35.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.088 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 29.5 ttm180 -70.96 140.59 50.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.772 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.965 -179.907 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.5 mtp . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.887 0.375 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.5 t -100.01 135.99 40.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.184 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -95.75 139.49 31.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.874 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -84.7 132.22 34.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.179 0.514 . . . . 0.0 110.995 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.445 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.4 t -117.69 128.21 74.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.041 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.4 mt -104.15 112.97 39.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.438 0.161 . . . . 0.0 111.312 -179.805 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 32.1 m -128.15 162.72 33.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 120.794 0.331 . . . . 0.0 111.469 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.3 mm -120.01 120.07 62.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.586 -179.382 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.4 119.65 20.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.745 179.664 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -92.48 -8.37 44.79 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.037 -179.759 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.436 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 7.3 m-90 -142.49 142.4 32.27 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.789 0.328 . . . . 0.0 110.859 -179.594 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -71.56 122.59 20.76 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.046 0.45 . . . . 0.0 110.95 -178.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.43 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 58.4 t80 -127.8 137.08 52.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.943 -179.908 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.6 m -103.77 139.06 39.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.653 179.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.438 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -55.71 136.73 50.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.575 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.556 ' CG ' ' HE2' ' A' ' 20' ' ' GLU . 14.4 pt20 -91.18 1.51 57.04 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.441 178.776 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.492 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 99.3 mt-30 -142.74 166.23 25.23 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.219 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -75.82 -20.9 57.81 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.136 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -90.16 -5.51 56.37 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -179.486 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.556 ' HE2' ' CG ' ' A' ' 16' ' ' GLN . 0.8 OUTLIER -87.25 -179.46 6.42 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.051 0.453 . . . . 0.0 111.499 -179.565 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.446 ' O ' HG13 ' A' ' 51' ' ' VAL . 14.2 tp -124.1 130.67 52.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.526 -178.069 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -72.82 147.54 45.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.467 179.303 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.43 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 37.2 pt -132.2 164.3 35.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.647 179.503 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.474 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 59.9 mttt -118.06 167.09 11.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.158 0.504 . . . . 0.0 110.975 179.808 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.436 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 52.6 pttt -66.45 -11.52 52.41 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.931 -179.575 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -141.78 27.73 1.82 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.965 0.412 . . . . 0.0 110.903 179.542 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.474 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 82.0 tt0 -99.69 140.7 33.5 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.208 0.528 . . . . 0.0 111.04 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.2 mtm180 -89.16 119.28 29.52 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.712 -179.928 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.727 ' HB3' HG22 ' A' ' 41' ' ' VAL . 3.0 mm? -115.23 139.9 49.55 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.806 -178.165 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.411 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 5.5 m-90 -103.83 104.42 14.42 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.308 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.577 HD11 ' HD2' ' A' ' 34' ' ' ASP . 33.6 mt -77.56 142.22 39.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.259 0.552 . . . . 0.0 112.05 -178.932 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -105.02 -26.7 12.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.04 -179.899 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -159.03 115.12 2.62 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.803 0.335 . . . . 0.0 110.788 179.739 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.577 ' HD2' HD11 ' A' ' 31' ' ' LEU . 88.6 m-20 -108.18 4.67 25.06 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.061 -179.746 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.4 p -71.19 -34.32 70.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.967 0.413 . . . . 0.0 111.026 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -83.78 158.14 21.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.716 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 81.3 m -59.32 -33.04 70.64 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.195 178.285 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.447 ' CD1' ' N ' ' A' ' 38' ' ' TRP . 5.5 m95 -98.74 131.7 44.68 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 177.554 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.429 ' CE3' HD11 ' A' ' 31' ' ' LEU . 35.9 m0 -103.87 130.94 51.5 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -177.404 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.44 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 39.6 ttt85 -88.09 136.4 32.99 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 177.601 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.727 HG22 ' HB3' ' A' ' 29' ' ' LEU . 2.4 p -150.36 155.17 7.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.831 -178.879 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -121.4 144.2 48.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.075 -179.709 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.439 ' HB2' ' CD2' ' A' ' 21' ' ' LEU . 43.8 t-20 -110.41 164.45 12.68 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.062 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.13 -25.4 65.45 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.256 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.26 3.72 8.36 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 179.382 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 73.96 24.36 2.06 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 120.749 0.309 . . . . 0.0 110.819 -179.621 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.4 mtm180 -108.05 131.56 54.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.069 179.52 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 30.6 p -126.34 147.86 49.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.144 -179.472 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.447 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.22 167.3 39.77 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.806 179.861 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.44 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.2 m-85 -99.63 106.44 18.39 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 117.082 0.441 . . . . 0.0 112.182 -179.23 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.519 HG11 ' HB3' ' A' ' 20' ' ' GLU . 14.0 m -124.94 114.47 26.54 Favored Pre-proline 0 CA--C 1.534 0.342 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 179.19 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.98 35.4 0.27 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 122.027 1.818 . . . . 0.0 112.211 177.698 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.418 ' H ' ' C ' ' A' ' 51' ' ' VAL . 7.5 t -67.93 81.46 0.21 Allowed 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 120.861 0.362 . . . . 0.0 110.426 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -57.11 -19.12 17.9 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.146 0.498 . . . . 0.0 110.626 178.375 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.419 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 91.8 m-85 -54.58 -16.52 2.47 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.728 179.447 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.6 p -115.69 140.49 37.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 120.958 0.408 . . . . 0.0 111.147 179.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -145.54 161.91 38.67 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.891 -179.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 67.5 ttp85 -72.48 142.15 48.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.902 179.805 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 94.3 mttt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.671 179.443 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.6 mmm . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.85 0.357 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.6 t -96.88 131.6 43.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -99.17 119.2 37.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.872 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.57 ' HE2' HH22 ' A' ' 42' ' ' ARG . 41.3 mt-10 -98.99 137.38 37.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.1 0.476 . . . . 0.0 111.114 -179.994 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.471 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 60.4 t -112.28 129.82 67.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.733 179.82 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.442 HG12 ' HD1' ' A' ' 30' ' ' TRP . 24.6 mt -102.6 120.61 52.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.08 -179.98 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.627 HG12 ' HB3' ' A' ' 58' ' ' ARG . 27.2 m -129.62 164.98 30.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.164 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.495 HG12 ' HG2' ' A' ' 28' ' ' ARG . 26.2 mt -123.14 123.8 68.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.687 179.545 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.9 120.51 21.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.346 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -90.04 -7.21 54.45 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.814 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.536 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 5.3 m-90 -144.48 143.25 30.78 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.819 0.343 . . . . 0.0 111.342 -179.604 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -70.45 121.58 18.03 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.548 179.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.448 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 63.6 t80 -127.66 140.13 52.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.966 0.412 . . . . 0.0 111.397 -179.476 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 75.0 m -102.21 137.97 39.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.683 179.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.459 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.8 139.23 54.5 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.488 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -89.93 -0.01 57.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.299 179.1 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.484 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 94.2 mt-30 -147.23 163.85 35.05 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 179.225 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -70.59 -24.72 62.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 111.814 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -82.91 -15.51 51.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.271 -0.422 . . . . 0.0 112.115 -179.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.484 ' CG ' ' HB2' ' A' ' 17' ' ' GLN . 0.6 OUTLIER -85.88 177.53 7.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.097 0.475 . . . . 0.0 110.431 179.749 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.401 HD12 ' C ' ' A' ' 20' ' ' GLU . 8.2 mp -129.43 142.41 50.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.489 -179.471 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -77.92 155.67 30.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.803 179.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.448 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 50.6 pt -133.55 165.02 33.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.478 179.59 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 40.0 mttp -115.76 165.73 12.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.062 0.458 . . . . 0.0 111.146 -179.652 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.536 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 22.4 pttp -64.97 -14.14 59.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.629 -179.328 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -138.92 25.72 2.51 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.189 179.738 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.484 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 80.8 tt0 -100.77 138.54 37.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.104 0.478 . . . . 0.0 110.967 -179.95 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.495 ' HG2' HG12 ' A' ' 8' ' ' ILE . 82.6 mtm180 -94.1 123.17 37.3 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.927 -179.853 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.555 ' HB3' ' CG2' ' A' ' 41' ' ' VAL . 0.5 OUTLIER -115.72 150.2 37.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.889 0.376 . . . . 0.0 111.1 -179.668 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.442 ' HD1' HG12 ' A' ' 6' ' ' ILE . 7.5 m-90 -101.38 111.73 24.04 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.267 179.917 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.471 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 72.0 mt -74.84 148.56 40.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.945 0.402 . . . . 0.0 111.416 -179.794 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.484 HD11 ' HA ' ' A' ' 41' ' ' VAL . 5.4 mp -111.31 -27.22 8.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.67 179.454 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -161.87 118.38 2.09 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.595 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.442 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 35.0 p-10 -110.02 6.76 23.29 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.655 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.0 p -71.87 -35.5 69.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.957 0.408 . . . . 0.0 111.212 -179.715 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -83.63 157.56 22.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.715 -179.491 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.8 m -57.32 -35.52 69.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.199 178.315 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -97.5 128.54 44.34 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.6 177.854 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.442 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 42.2 m0 -99.03 140.23 33.5 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -177.903 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.524 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 47.8 ttt180 -99.56 134.47 42.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.075 -0.966 . . . . 0.0 108.778 178.081 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.555 ' CG2' ' HB3' ' A' ' 29' ' ' LEU . 0.5 OUTLIER -136.53 161.92 36.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.924 0.392 . . . . 0.0 111.8 -178.455 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.57 HH22 ' HE2' ' A' ' 4' ' ' GLU . 37.9 ttp-105 -126.5 143.06 51.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.091 179.658 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 44.4 p-10 -110.81 169.39 8.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.55 -179.452 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.85 -22.57 64.36 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.355 179.827 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.73 5.79 3.72 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.793 179.214 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 67.58 22.65 9.09 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 121.015 0.436 . . . . 0.0 110.957 -179.264 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -109.43 137.97 46.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.306 179.335 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 52.2 p -121.52 161.56 22.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.752 0.311 . . . . 0.0 110.988 -179.803 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.33 174.77 47.24 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.692 -179.876 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.524 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 95.6 m-85 -107.7 111.23 23.33 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.783 0.325 . . . . 0.0 111.386 -179.684 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.443 ' C ' ' H ' ' A' ' 53' ' ' SER . 21.5 t -122.41 109.54 32.89 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.189 179.609 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.05 32.64 0.27 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.214 1.943 . . . . 0.0 112.313 178.876 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.443 ' H ' ' C ' ' A' ' 51' ' ' VAL . 8.8 t -72.93 87.01 1.31 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 120.948 0.404 . . . . 0.0 111.065 -179.675 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -67.14 -8.66 32.67 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.757 178.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -63.34 -10.08 14.86 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.856 179.418 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.6 p -118.05 142.11 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-O 120.895 0.378 . . . . 0.0 110.801 179.878 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -147.04 159.56 43.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.824 -179.712 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.627 ' HB3' HG12 ' A' ' 7' ' ' VAL . 29.4 ptt180 -71.43 144.44 49.75 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.798 0.332 . . . . 0.0 111.18 179.836 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.9 tttt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.19 -0.909 . . . . 0.0 110.716 179.341 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.8 ttp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.841 0.353 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 64.5 p -77.95 153.2 32.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.978 179.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -90.58 -6.97 54.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.664 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -70.69 141.42 51.6 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.068 0.461 . . . . 0.0 110.963 179.819 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.447 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 58.4 t -112.61 130.82 65.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.442 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.1 mt -115.35 119.28 61.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.167 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.459 ' CG1' ' HG2' ' A' ' 58' ' ' ARG . 28.0 m -132.16 161.13 41.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.08 179.477 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.465 HD12 ' HB3' ' A' ' 28' ' ' ARG . 28.0 mm -116.55 127.85 74.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.435 179.534 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.23 148.18 39.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -179.669 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 63.6 mttp -113.6 -16.83 12.29 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.671 179.951 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.51 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 16.1 m-90 -142.42 137.97 30.75 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.102 0.477 . . . . 0.0 110.655 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -63.62 123.74 19.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.035 -178.863 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.469 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 55.5 t80 -127.89 139.55 52.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.63 -179.613 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.15 138.62 40.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.191 179.212 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.457 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -55.27 127.42 29.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.445 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.41 ' OE1' ' CZ3' ' A' ' 38' ' ' TRP . 96.0 mt-30 -62.36 -35.02 77.82 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.148 0.499 . . . . 0.0 110.367 179.678 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -129.3 162.0 28.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.097 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -61.89 -34.66 76.44 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.014 0.435 . . . . 0.0 111.157 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -63.11 -24.75 68.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.444 -179.823 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.457 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 1.3 mm-40 -81.04 -179.58 7.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.117 0.485 . . . . 0.0 110.131 179.621 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 tp -119.42 144.58 46.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.517 -178.524 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -85.31 143.57 28.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.761 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.469 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 38.8 pt -131.0 162.92 38.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.651 179.539 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 72.0 mmtt -110.97 176.2 5.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.163 0.506 . . . . 0.0 111.064 179.691 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.496 ' HG3' ' HA ' ' A' ' 11' ' ' TRP . 28.6 ttpp -63.08 -45.91 89.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.841 -178.827 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -109.76 -0.25 18.55 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.463 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 78.5 tt0 -64.63 145.3 56.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.423 0.63 . . . . 0.0 111.19 -179.405 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.465 ' HB3' HD12 ' A' ' 8' ' ' ILE . 22.4 ptt-85 -99.26 121.96 41.77 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.533 -179.992 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.763 ' HB3' HG23 ' A' ' 41' ' ' VAL . 2.0 mm? -113.38 146.55 39.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.555 -179.099 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -102.11 108.35 19.73 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.268 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.447 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 83.8 mt -75.04 150.75 38.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.033 0.444 . . . . 0.0 111.638 -179.517 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.503 HD13 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -112.63 -28.43 7.82 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.664 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -160.99 118.47 2.36 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.853 0.359 . . . . 0.0 110.768 179.763 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.457 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 32.7 p-10 -106.84 1.23 24.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.282 -179.765 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.4 m -63.9 -37.36 87.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.889 0.376 . . . . 0.0 111.687 -179.435 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -81.91 158.67 23.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.148 -179.133 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.7 m -58.96 -37.01 75.78 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 177.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.41 ' CZ3' ' OE1' ' A' ' 16' ' ' GLN . 26.7 m95 -96.37 129.35 43.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.51 177.697 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.457 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 36.2 m0 -99.21 138.78 35.82 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.825 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.445 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 69.7 ttt180 -97.04 132.77 42.51 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.188 178.378 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.763 HG23 ' HB3' ' A' ' 29' ' ' LEU . 2.1 p -140.83 155.91 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.143 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 37.4 ttm180 -125.23 140.16 53.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.69 -179.282 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 47.6 p-10 -108.92 172.13 7.03 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.174 0.512 . . . . 0.0 111.749 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.2 -24.34 67.16 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.168 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.36 3.47 5.88 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 179.472 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.6 t30 69.57 24.96 5.42 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 120.861 0.362 . . . . 0.0 111.28 -179.89 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -112.98 136.07 53.06 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.087 179.133 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.4 p -125.0 156.76 37.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.042 0.449 . . . . 0.0 111.704 -179.026 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -173.26 173.16 45.61 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.458 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.445 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.7 m-85 -102.66 110.12 21.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.882 0.372 . . . . 0.0 110.462 179.836 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.1 t -121.98 110.14 33.27 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.658 -179.737 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -73.99 35.87 0.39 Allowed 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 121.824 1.682 . . . . 0.0 112.46 177.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.1 t -68.54 87.52 0.32 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.826 0.345 . . . . 0.0 111.074 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -59.83 -18.33 43.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.188 0.518 . . . . 0.0 110.062 177.54 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.51 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.9 m-85 -56.0 -17.05 5.78 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.657 179.589 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.1 p -113.07 142.98 23.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 CA-C-O 121.047 0.451 . . . . 0.0 110.86 -179.821 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -141.86 159.94 41.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.766 -179.649 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.459 ' HG2' ' CG1' ' A' ' 7' ' ' VAL . 78.8 mtp180 -69.59 141.62 53.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.835 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.721 179.58 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.0 ttm . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 120.83 0.348 . . . . 0.0 111.376 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 60.3 p -97.89 129.74 44.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.017 0.437 . . . . 0.0 111.041 179.723 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -100.97 127.62 47.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.759 179.678 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -71.47 144.43 49.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.012 0.434 . . . . 0.0 110.846 179.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.443 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.8 t -110.21 128.65 66.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.42 179.836 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.6 mm -98.42 117.38 43.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.994 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.1 m -135.12 162.3 38.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.145 0.498 . . . . 0.0 112.05 -179.699 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.4 mt -122.51 124.08 69.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.798 -179.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.401 ' HA ' ' CG2' ' A' ' 56' ' ' VAL . . . -76.59 119.94 21.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.073 0.463 . . . . 0.0 111.702 -179.491 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -91.56 -7.68 49.56 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.169 -179.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.679 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 15.9 m-90 -142.41 143.74 32.8 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.919 0.39 . . . . 0.0 110.536 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.7 p-10 -74.16 121.54 21.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.364 -179.13 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.428 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 60.9 t80 -127.91 138.22 52.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.67 179.914 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.3 t -101.41 142.57 32.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.768 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.462 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -58.03 132.42 53.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.836 -179.717 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.408 ' OE1' ' CH2' ' A' ' 38' ' ' TRP . 92.8 mt-30 -66.75 -30.38 70.58 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 121.131 0.491 . . . . 0.0 110.244 179.165 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -132.66 161.42 33.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.125 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -62.29 -31.95 72.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.895 0.379 . . . . 0.0 111.9 -179.163 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -71.17 -15.39 62.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.72 -179.744 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.682 ' HB3' HG11 ' A' ' 51' ' ' VAL . 2.4 mm-40 -84.79 -178.97 7.0 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.356 -179.388 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.459 ' CD2' ' HB2' ' A' ' 43' ' ' ASN . 13.1 tp -125.79 123.87 39.73 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -177.884 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -68.43 152.67 45.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.716 179.401 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.428 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 45.5 pt -133.98 162.13 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.098 179.249 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -117.11 164.84 14.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.285 0.564 . . . . 0.0 111.22 -179.934 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 52.0 pttt -64.54 -13.49 52.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.954 -179.591 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -140.72 24.77 2.21 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.331 179.643 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -102.25 135.64 43.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.158 0.504 . . . . 0.0 110.871 179.845 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.0 mtm-85 -89.49 120.71 31.05 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.69 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.489 ' HB3' HG22 ' A' ' 41' ' ' VAL . 2.8 mm? -110.95 145.89 37.57 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.131 -177.792 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 27.1 m-90 -99.73 105.05 16.81 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.611 0.243 . . . . 0.0 111.216 179.173 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.443 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 96.1 mt -76.22 148.63 37.53 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.116 0.484 . . . . 0.0 111.2 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.502 HD11 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -112.77 -32.38 6.43 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.624 179.902 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -156.99 114.72 3.17 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.396 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.437 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 29.9 p-10 -109.27 1.79 20.4 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -179.035 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.4 m -65.02 -36.02 83.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.876 0.37 . . . . 0.0 111.584 -179.626 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -82.42 158.33 23.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.509 0.671 . . . . 0.0 112.488 -179.042 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 20.1 p -55.58 -39.42 70.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.354 178.112 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.408 ' CH2' ' OE1' ' A' ' 16' ' ' GLN . 28.8 m95 -93.26 133.28 36.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.759 -1.11 . . . . 0.0 108.285 177.24 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.437 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 33.9 m0 -105.48 131.35 53.01 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -177.871 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 29.6 ttp180 -91.06 133.11 35.58 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.753 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.502 ' HA ' HD11 ' A' ' 32' ' ' LEU . 2.7 p -143.61 159.72 16.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 C-N-CA 120.268 -0.573 . . . . 0.0 112.257 -177.554 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -119.57 152.65 36.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.456 -179.08 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.459 ' HB2' ' CD2' ' A' ' 21' ' ' LEU . 58.4 t30 -120.46 159.73 24.55 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.749 0.309 . . . . 0.0 111.058 179.418 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.56 -21.34 52.47 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.849 178.765 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.45 5.7 14.37 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.171 179.19 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.8 m120 70.07 22.28 5.75 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 122.592 0.357 . . . . 0.0 111.311 -179.249 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 82.7 mtt85 -109.16 127.31 54.09 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.055 178.808 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.4 p -123.12 151.06 42.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.148 -179.61 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.421 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.57 174.9 40.63 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.561 179.856 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -105.16 110.88 23.43 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 117.0 0.4 . . . . 0.0 111.93 -179.436 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.682 HG11 ' HB3' ' A' ' 20' ' ' GLU . 16.0 m -132.46 115.45 14.85 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.12 178.661 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.35 43.58 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.773 1.649 . . . . 0.0 111.966 178.878 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.7 m -63.76 97.07 0.14 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.019 0.438 . . . . 0.0 110.462 -179.78 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -72.24 -15.67 61.93 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.498 179.093 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.679 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 89.2 m-85 -69.1 -10.47 57.79 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.452 -179.536 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.401 ' CG2' ' HA ' ' A' ' 9' ' ' ALA . 9.2 p -113.24 139.73 37.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 O-C-N 121.732 -0.605 . . . . 0.0 110.781 179.358 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -144.94 160.05 41.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.357 -179.81 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.9 ptt-85 -70.13 137.2 50.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.266 -179.475 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 61.9 tttm . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.744 179.81 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.8 mtp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.719 0.295 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.5 m -81.93 128.5 34.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.056 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -100.46 138.11 37.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.955 179.995 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -98.77 139.35 34.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 56.0 t -117.48 129.14 74.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.511 179.833 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.8 mt -104.73 121.01 56.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.825 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.535 HG11 ' HB3' ' A' ' 58' ' ' ARG . 25.5 m -132.72 161.07 42.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.97 0.414 . . . . 0.0 111.781 -179.798 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.525 HG12 ' HG2' ' A' ' 28' ' ' ARG . 16.9 mt -120.99 128.05 76.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.005 -179.918 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.401 ' N ' HG23 ' A' ' 56' ' ' VAL . . . -77.64 127.26 32.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.004 -179.988 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -93.74 -13.31 27.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.449 179.596 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.455 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 7.3 m-90 -140.58 154.12 46.37 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-O 120.999 0.428 . . . . 0.0 111.311 -179.699 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.413 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 11.4 t70 -76.58 123.82 26.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.525 -179.493 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.453 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 63.3 t80 -127.97 140.36 52.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.157 -179.776 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.1 m -104.19 138.02 41.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.703 179.571 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.433 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -59.0 138.03 57.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.784 -179.814 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -86.77 -0.27 56.06 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.455 178.703 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.513 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 78.1 mt-30 -147.75 167.42 24.73 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.135 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -73.67 -29.97 62.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.007 0.432 . . . . 0.0 111.361 -179.638 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -76.25 -14.94 60.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.208 -179.393 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.649 ' HB3' HG11 ' A' ' 51' ' ' VAL . 0.6 OUTLIER -85.79 178.08 7.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.915 0.388 . . . . 0.0 111.04 -179.467 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.462 ' O ' HG13 ' A' ' 51' ' ' VAL . 7.6 mp -124.85 141.64 51.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.3 0.572 . . . . 0.0 111.481 -178.19 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -80.77 147.78 30.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.746 179.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.453 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 47.0 pt -129.2 164.88 30.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.222 179.228 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.409 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 68.8 mttm -116.5 176.78 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.18 0.514 . . . . 0.0 112.037 -179.095 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.455 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 28.1 mttt -61.7 -30.17 70.57 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.838 -179.871 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -133.78 53.34 2.01 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.064 0.459 . . . . 0.0 110.903 -179.483 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.45 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 80.2 tt0 -117.08 137.69 52.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.038 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.525 ' HG2' HG12 ' A' ' 8' ' ' ILE . 94.0 mtm-85 -96.77 122.79 40.11 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.197 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.578 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -117.04 147.88 41.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.081 -179.873 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.2 m-90 -99.99 106.53 18.33 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.209 179.762 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.485 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 80.0 mt -76.24 146.39 39.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.094 0.473 . . . . 0.0 111.633 -179.401 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.49 HD11 ' HG2' ' A' ' 40' ' ' ARG . 5.3 mp -111.69 -30.51 7.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.753 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.478 ' HD2' ' HB2' ' A' ' 35' ' ' SER . 51.8 t0 -161.01 120.13 2.57 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.474 179.548 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.456 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.1 p-10 -110.84 1.54 17.74 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -179.46 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.478 ' HB2' ' HD2' ' A' ' 33' ' ' ASP . 70.7 m -63.41 -39.04 93.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.741 0.305 . . . . 0.0 111.532 -179.576 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -81.72 158.82 24.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.007 0.432 . . . . 0.0 111.656 -179.511 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.9 -35.01 68.49 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.077 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.582 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 61.2 m95 -96.92 129.38 44.38 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.453 177.668 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.484 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 39.4 m0 -104.17 132.71 50.14 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -177.662 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.553 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 65.5 ttt180 -87.92 134.12 33.78 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.592 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.578 HG23 ' HB3' ' A' ' 29' ' ' LEU . 1.2 p -139.73 161.22 27.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.761 -178.796 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -125.54 142.01 51.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.837 -179.715 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -111.88 165.63 11.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.471 -179.523 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.69 -27.67 65.04 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.448 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -72.8 5.11 3.42 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.886 179.191 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.6 m120 69.23 25.68 5.61 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.002 0.43 . . . . 0.0 111.058 -179.659 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 21.8 ttt180 -110.72 131.5 55.0 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.221 179.227 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 75.7 p -119.73 156.87 29.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.146 -179.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.46 177.7 44.94 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.103 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.553 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.0 m-85 -108.73 115.01 29.28 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.464 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.649 HG11 ' HB3' ' A' ' 20' ' ' GLU . 12.6 m -128.59 110.32 19.06 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.601 179.407 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.582 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 57.9 Cg_endo -72.41 32.41 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.406 2.071 . . . . 0.0 112.218 178.481 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.518 ' O ' HG13 ' A' ' 56' ' ' VAL . 11.7 t -68.4 84.81 0.27 Allowed 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.471 -179.917 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -64.65 -11.3 33.92 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.866 178.743 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -62.93 -9.84 11.32 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 179.591 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.518 HG13 ' O ' ' A' ' 53' ' ' SER . 6.2 p -117.91 139.1 46.37 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-O 121.022 0.439 . . . . 0.0 110.679 179.663 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -142.54 161.9 36.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.624 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.535 ' HB3' HG11 ' A' ' 7' ' ' VAL . 33.2 ptt-85 -71.14 141.12 50.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.875 0.369 . . . . 0.0 111.218 -179.803 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.6 tttt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.142 -0.932 . . . . 0.0 110.671 179.551 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.1 mtp . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 120.787 0.327 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.6 p -88.87 -3.83 58.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.485 179.812 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -98.83 137.17 37.8 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.972 0.415 . . . . 0.0 110.99 179.969 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -86.73 141.16 29.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.211 0.529 . . . . 0.0 111.14 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.0 t -109.31 130.97 61.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.553 179.805 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.2 mt -115.37 118.38 58.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.333 -179.647 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.431 ' CG1' ' HG2' ' A' ' 58' ' ' ARG . 29.1 m -132.14 160.21 42.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.941 0.4 . . . . 0.0 111.278 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.414 HD11 HG22 ' A' ' 8' ' ' ILE . 35.3 mt -116.75 126.87 74.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.472 179.577 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.0 149.83 39.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.587 -179.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -112.37 -20.65 11.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.183 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.507 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 16.4 m-90 -140.42 150.58 44.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.641 -179.944 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.425 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 50.9 t0 -72.97 124.57 25.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.346 -179.322 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.424 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 57.1 t80 -127.52 133.89 49.81 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.577 179.621 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.5 m -101.51 139.15 37.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.047 0.451 . . . . 0.0 111.104 -179.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.503 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -55.23 129.72 39.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.693 -179.905 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -65.53 -31.8 73.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.118 0.485 . . . . 0.0 110.008 179.345 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.4 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 96.3 mt-30 -130.99 163.81 26.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.114 179.623 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -64.61 -34.69 78.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.97 0.414 . . . . 0.0 111.266 -179.622 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.1 -19.39 65.96 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.444 -179.882 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.75 ' HB3' HG12 ' A' ' 51' ' ' VAL . 1.9 mm-40 -82.63 -178.93 7.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.65 0.262 . . . . 0.0 111.175 -179.803 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.513 ' O ' HG11 ' A' ' 51' ' ' VAL . 26.1 tp -120.79 134.44 55.29 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.161 0.505 . . . . 0.0 112.167 -178.326 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -78.86 145.64 34.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.15 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.419 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 31.3 pt -132.66 163.82 36.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.071 179.129 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -114.6 -176.74 2.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.232 0.539 . . . . 0.0 111.514 -179.545 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.449 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 63.6 mttt -63.37 -57.47 10.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.938 -179.494 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -100.02 -12.73 19.48 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.47 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.42 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 77.1 tt0 -51.83 143.15 13.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.886 0.374 . . . . 0.0 111.681 -178.989 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -97.78 124.99 42.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.977 -179.858 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.577 ' HB3' HG23 ' A' ' 41' ' ' VAL . 1.7 mm? -114.27 143.3 45.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.064 0.459 . . . . 0.0 111.695 -179.254 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.0 m-90 -101.42 105.87 16.94 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.557 179.727 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.774 ' HB3' ' HD2' ' A' ' 34' ' ' ASP . 79.3 mt -69.87 149.87 47.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.303 0.573 . . . . 0.0 111.936 -179.024 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.563 HD22 ' N ' ' A' ' 32' ' ' LEU . 3.6 mm? -119.29 -31.88 4.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.797 -178.23 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -113.28 -83.74 0.6 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.114 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.774 ' HD2' ' HB3' ' A' ' 31' ' ' LEU . 18.2 m-20 72.01 3.84 4.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.899 -179.418 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.1 m -82.5 -36.04 26.82 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.886 0.374 . . . . 0.0 111.151 179.883 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -104.17 168.84 8.85 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.997 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 16.0 m -55.68 -30.31 60.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.673 178.494 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -97.56 126.97 43.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.854 178.253 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.495 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 42.5 m0 -106.88 134.22 50.35 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.582 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.476 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 58.4 ttp180 -92.24 127.21 37.63 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 177.475 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.577 HG23 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -135.1 161.73 39.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -178.293 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.1 ttm-85 -123.25 139.9 53.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.713 -179.547 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.404 ' HB2' HD23 ' A' ' 21' ' ' LEU . 52.4 t30 -110.34 161.57 15.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.864 0.364 . . . . 0.0 111.274 179.878 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.25 -21.03 46.77 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.552 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.93 5.03 14.97 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.836 179.735 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 72.78 22.57 3.1 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.852 0.358 . . . . 0.0 111.001 -179.637 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -107.23 132.44 53.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.158 179.242 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 73.2 p -127.27 151.0 49.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.696 0.284 . . . . 0.0 111.079 -179.592 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.479 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -170.5 172.84 44.27 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.577 -0.821 . . . . 0.0 113.115 -179.973 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.476 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 85.8 m-85 -101.52 114.04 27.7 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.641 0.258 . . . . 0.0 111.134 -179.905 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.75 HG12 ' HB3' ' A' ' 20' ' ' GLU . 15.7 m -136.05 114.15 10.77 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.737 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.24 43.21 0.84 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.164 1.909 . . . . 0.0 111.865 178.618 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.424 ' HB3' ' CD1' ' A' ' 13' ' ' TYR . 88.6 p -71.07 90.3 0.85 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.001 0.429 . . . . 0.0 111.282 -179.383 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -66.21 -12.68 57.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.371 178.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.507 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.0 m-85 -62.63 -12.95 26.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.159 -179.995 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -115.35 141.18 33.3 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.099 0 CA-C-O 120.95 0.405 . . . . 0.0 110.695 179.723 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -137.94 164.73 28.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.331 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.431 ' HG2' ' CG1' ' A' ' 7' ' ' VAL . 17.1 mtp-105 -69.93 143.88 52.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.66 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.142 -0.932 . . . . 0.0 110.992 179.947 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.4 mtp . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.874 0.369 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 75.6 p -79.37 153.88 29.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.966 179.887 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -80.84 149.12 29.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.852 179.817 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -94.8 136.85 34.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.094 0.474 . . . . 0.0 111.164 -179.864 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.409 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.5 t -117.45 131.53 69.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.708 179.915 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.7 mt -113.87 116.06 51.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.98 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 23.0 m -132.23 161.1 41.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.837 0.351 . . . . 0.0 111.568 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.479 ' CD1' ' HD2' ' A' ' 59' ' ' LYS . 15.5 mt -119.0 123.0 70.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.288 -179.668 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.407 ' HA ' ' CG2' ' A' ' 56' ' ' VAL . . . -75.62 123.58 25.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.631 -179.718 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.422 ' HE3' ' HE2' ' A' ' 59' ' ' LYS . 38.8 mttp -93.7 -10.63 33.74 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.081 -179.955 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.74 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 11.1 m-90 -140.74 145.11 35.99 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.944 0.402 . . . . 0.0 110.839 179.841 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -72.81 122.21 21.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.083 -179.281 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.449 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 57.5 t80 -127.55 139.77 52.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.101 179.99 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 91.1 m -103.02 138.96 39.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.675 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.423 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -61.88 139.23 58.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.519 -179.667 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -87.83 -1.23 57.84 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.464 179.23 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.481 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 93.1 mt-30 -145.99 169.71 18.08 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 178.791 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -75.13 -33.36 61.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.106 0.479 . . . . 0.0 110.945 -179.645 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -71.43 -16.32 62.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.925 -179.635 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.577 ' HE2' ' HZ3' ' A' ' 38' ' ' TRP . 0.4 OUTLIER -86.56 178.73 6.98 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.022 -179.649 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.466 ' O ' HG13 ' A' ' 51' ' ' VAL . 7.1 mp -129.59 139.04 51.57 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-O 121.098 0.475 . . . . 0.0 111.859 -177.754 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -74.72 148.55 40.41 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.852 179.324 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 41.8 pt -129.29 164.0 32.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.911 179.221 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.416 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 96.9 mttt -118.99 163.64 16.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.141 0.496 . . . . 0.0 111.141 -179.858 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.468 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 10.8 pttm -63.87 -10.53 21.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.52 -0.764 . . . . 0.0 113.029 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -140.68 26.4 2.11 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.013 179.494 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.458 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 82.4 tt0 -102.03 143.11 32.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.046 0.45 . . . . 0.0 110.705 179.899 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.421 ' HG2' HG12 ' A' ' 8' ' ' ILE . 82.6 mtm-85 -95.33 119.41 33.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.291 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.543 ' HB3' HG23 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -116.12 145.21 43.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.128 -179.661 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -100.92 107.53 19.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.492 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.417 ' HA ' HG21 ' A' ' 41' ' ' VAL . 63.6 mt -77.9 149.66 34.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.119 0.485 . . . . 0.0 111.538 -179.583 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.474 HD11 ' HA ' ' A' ' 41' ' ' VAL . 4.8 mp -114.55 -29.84 6.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.039 179.795 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -157.05 115.0 3.19 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.883 0.373 . . . . 0.0 110.601 179.772 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.469 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 35.7 p-10 -106.28 2.34 26.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.229 -179.49 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 87.6 p -67.67 -37.63 82.62 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.904 0.383 . . . . 0.0 111.904 -179.351 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -81.61 162.08 23.24 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.328 0.585 . . . . 0.0 112.38 -179.044 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 17.1 p -57.55 -39.74 77.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.856 177.838 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.577 ' HZ3' ' HE2' ' A' ' 20' ' ' GLU . 54.3 m95 -96.97 130.21 44.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.47 -1.241 . . . . 0.0 108.745 177.791 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.469 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 38.2 m0 -102.62 132.97 48.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -177.862 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.481 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 51.9 ttt180 -87.45 132.07 34.12 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 177.794 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.543 HG23 ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -138.9 157.12 28.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.926 0.393 . . . . 0.0 111.81 -178.724 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -119.49 142.97 47.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.988 -179.664 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -113.08 163.16 15.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.391 -179.502 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.23 -20.68 43.73 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.463 179.769 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.79 5.79 8.8 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 179.679 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.1 m120 68.48 26.92 6.43 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 120.948 0.404 . . . . 0.0 111.307 -179.903 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -115.05 144.5 43.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.55 178.719 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 75.5 p -129.74 153.91 47.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.568 0.223 . . . . 0.0 110.715 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.401 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -169.02 176.12 43.24 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.552 -179.728 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.481 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 94.7 m-85 -108.13 114.6 28.62 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.217 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.534 HG11 ' HB3' ' A' ' 20' ' ' GLU . 6.0 m -133.16 111.22 12.98 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.812 179.255 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.499 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 13.7 Cg_exo -70.18 41.16 0.34 Allowed 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.734 2.29 . . . . 0.0 112.502 178.487 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.57 ' O ' HG11 ' A' ' 56' ' ' VAL . 6.7 p -69.03 74.19 0.3 Allowed 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 120.676 0.274 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -54.13 -17.51 2.82 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.146 -0.346 . . . . 0.0 111.223 178.708 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.74 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 91.1 m-85 -61.43 -8.06 3.71 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 179.26 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.57 HG11 ' O ' ' A' ' 53' ' ' SER . 9.2 p -111.2 140.15 31.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 O-C-N 121.386 -0.821 . . . . 0.0 110.727 179.808 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -136.55 150.57 48.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.224 179.803 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 33.6 ptt-85 -72.0 147.26 47.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.315 -179.465 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.479 ' HD2' ' CD1' ' A' ' 8' ' ' ILE . 98.5 mttt . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.306 -0.854 . . . . 0.0 110.82 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.5 ttm . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 80.5 p -80.25 147.73 31.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.1 -179.983 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -100.13 130.96 46.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.01 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -93.19 132.71 37.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.039 0.447 . . . . 0.0 111.212 -179.955 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.458 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 79.2 t -118.67 129.13 75.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.785 -179.9 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.5 mt -105.59 114.71 45.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.712 0.291 . . . . 0.0 111.751 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.434 ' CG1' ' HG2' ' A' ' 58' ' ' ARG . 30.8 m -132.98 159.46 43.17 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.741 0.305 . . . . 0.0 110.987 179.054 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.583 ' HB ' ' HD2' ' A' ' 59' ' ' LYS . 54.3 mt -121.5 124.28 71.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.062 0.458 . . . . 0.0 111.395 179.96 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.13 124.76 27.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.085 -179.989 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -93.08 -9.18 40.5 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.837 -179.992 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.753 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 14.3 m-90 -143.58 147.06 33.84 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.866 0.365 . . . . 0.0 110.473 179.431 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.3 p-10 -73.67 124.04 25.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.438 -178.719 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.436 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 46.3 t80 -128.64 135.09 48.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.511 179.173 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 66.8 m -100.36 139.88 35.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.267 0.556 . . . . 0.0 111.489 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.512 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.43 130.51 46.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.488 179.813 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -65.16 -28.21 69.25 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.015 0.436 . . . . 0.0 110.246 179.106 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.405 ' O ' ' HB1' ' A' ' 15' ' ' ALA . 97.5 mt-30 -135.45 162.33 32.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.111 179.36 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -64.16 -29.91 71.0 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.904 0.383 . . . . 0.0 111.274 -179.705 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -69.48 -19.25 63.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.634 -179.757 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.512 ' HB2' ' CB ' ' A' ' 15' ' ' ALA . 2.3 mm-40 -82.55 -177.56 6.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.512 179.888 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.44 HD23 ' CG1' ' A' ' 41' ' ' VAL . 20.3 tp -123.7 133.14 53.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.138 0.494 . . . . 0.0 111.692 -178.913 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -77.65 148.56 34.97 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.806 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.436 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 36.6 pt -131.93 163.56 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.335 179.39 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.412 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 73.4 mmtt -118.38 164.2 15.6 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.144 0.497 . . . . 0.0 111.352 179.919 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.487 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 33.4 pttt -65.74 -11.11 42.91 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -179.671 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -140.6 23.34 2.3 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.168 179.638 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.474 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 78.6 tt0 -102.62 139.73 37.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.067 0.46 . . . . 0.0 110.695 179.939 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.545 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 11.9 ptp180 -95.25 121.38 36.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.212 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.519 ' HB3' HG22 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -113.58 152.69 29.96 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.517 -178.966 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.411 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 11.2 m-90 -103.36 105.57 15.87 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.501 -179.661 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.458 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 71.8 mt -77.63 146.34 36.19 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.076 0.465 . . . . 0.0 111.865 -179.335 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.476 HD11 ' HA ' ' A' ' 41' ' ' VAL . 4.9 mp -110.63 -29.53 7.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.203 179.976 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -158.96 116.74 2.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.865 0.364 . . . . 0.0 110.698 -179.672 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.462 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 42.6 p-10 -108.83 4.49 23.62 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.114 -179.381 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.7 m -68.32 -35.57 77.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.84 0.352 . . . . 0.0 111.383 -179.429 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -84.27 158.4 21.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.071 -179.162 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.3 p -55.36 -40.65 71.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.337 -0.847 . . . . 0.0 108.841 177.74 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.568 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 56.2 m95 -93.84 129.28 40.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.452 -1.249 . . . . 0.0 109.102 177.845 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.477 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 37.4 m0 -101.16 137.61 39.29 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.055 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.48 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 64.5 ttt180 -93.03 135.36 34.27 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 177.443 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.519 HG22 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -145.63 159.19 12.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.569 -178.935 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.421 ' HB2' HG21 ' A' ' 48' ' ' THR . 78.1 ttt180 -124.02 144.08 50.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.154 179.999 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -113.43 163.35 14.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.308 179.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.42 -24.7 63.7 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.662 -179.974 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.28 5.72 8.03 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.691 179.059 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 71.92 20.55 4.41 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.314 0.245 . . . . 0.0 111.08 -179.813 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.405 ' HG2' HD13 ' A' ' 21' ' ' LEU . 77.0 ttt180 -105.89 125.16 50.66 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.597 179.644 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.421 HG21 ' HB2' ' A' ' 42' ' ' ARG . 76.9 p -121.13 149.86 42.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.126 -179.732 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.62 176.74 40.43 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.639 179.719 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.48 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 85.7 m-85 -107.64 110.85 22.83 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.878 0.339 . . . . 0.0 111.579 -179.87 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.441 HG12 ' HB3' ' A' ' 20' ' ' GLU . 12.1 m -134.08 117.05 13.55 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 111.493 0.183 . . . . 0.0 111.493 179.515 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.568 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 57.6 Cg_endo -71.75 53.47 1.87 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.319 2.013 . . . . 0.0 111.613 179.111 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.406 ' O ' HG11 ' A' ' 56' ' ' VAL . 1.8 m -66.92 92.99 0.25 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.093 -179.513 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.3 m120 -77.26 -10.4 59.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.902 0.382 . . . . 0.0 110.186 178.055 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.753 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 86.1 m-85 -81.37 6.24 15.03 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.323 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.406 HG11 ' O ' ' A' ' 53' ' ' SER . 13.2 p -118.08 144.66 25.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 O-C-N 121.946 -0.472 . . . . 0.0 110.51 179.591 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -128.09 156.82 42.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.824 -179.674 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.434 ' HG2' ' CG1' ' A' ' 7' ' ' VAL . 17.1 mtp-105 -73.43 142.44 46.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.793 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.583 ' HD2' ' HB ' ' A' ' 8' ' ' ILE . 56.3 mttm . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.876 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.1 mtm . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.4 m -80.51 138.85 36.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.811 0.339 . . . . 0.0 110.866 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -90.89 139.07 31.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.864 -179.955 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -99.59 138.28 36.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.092 0.472 . . . . 0.0 111.195 -179.856 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.401 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 58.6 t -111.92 130.16 66.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.32 179.716 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.423 HG12 ' CD1' ' A' ' 30' ' ' TRP . 50.3 mt -111.28 117.39 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.008 179.8 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 32.9 m -131.18 160.79 42.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.071 179.646 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.494 HD11 ' HD2' ' A' ' 59' ' ' LYS . 16.8 mt -119.84 122.17 67.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.822 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.01 124.33 27.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.265 -179.925 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.423 ' CE ' ' HE2' ' A' ' 59' ' ' LYS . 94.8 mttt -92.97 -11.05 34.21 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.905 179.813 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.66 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 9.2 m-90 -140.42 146.51 38.4 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.744 0.307 . . . . 0.0 110.553 -179.762 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -75.57 124.08 26.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.238 0.542 . . . . 0.0 111.553 -178.371 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.468 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 59.0 t80 -128.05 136.48 51.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.623 179.683 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 59.6 m -103.82 139.99 38.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.815 179.777 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.458 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -58.06 137.09 57.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.891 -179.937 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -86.72 -3.77 59.09 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.234 178.486 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.442 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 81.5 mm-40 -143.07 162.64 34.97 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.857 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -71.93 -19.67 61.87 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.706 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -89.21 -10.67 46.16 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -179.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.55 ' HA ' ' HA3' ' A' ' 49' ' ' GLY . 1.1 mt-10 -83.33 179.54 7.66 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.036 0.446 . . . . 0.0 110.247 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.674 HD22 ' HB2' ' A' ' 43' ' ' ASN . 15.9 tp -122.84 128.49 50.45 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.914 -178.394 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -71.76 147.62 47.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.41 179.729 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.468 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 40.1 pt -132.23 161.87 40.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.761 179.461 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 99.0 mttt -117.67 163.09 16.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.073 0.464 . . . . 0.0 111.226 -179.87 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.452 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 55.4 pttt -64.18 -12.17 37.79 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -179.667 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -138.84 22.94 2.65 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.942 179.355 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.44 ' HG3' HD22 ' A' ' 29' ' ' LEU . 51.6 tp10 -100.12 140.93 33.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.105 0.478 . . . . 0.0 111.219 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.437 ' HG2' HG12 ' A' ' 8' ' ' ILE . 61.2 mtt85 -91.94 122.43 34.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.704 -179.852 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.652 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.4 mm? -115.29 145.31 42.6 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.612 -178.386 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.423 ' CD1' HG12 ' A' ' 6' ' ' ILE . 6.3 m0 -101.65 107.63 18.94 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.547 179.648 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.408 ' HA ' HG22 ' A' ' 41' ' ' VAL . 92.9 mt -79.18 148.83 32.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.342 0.591 . . . . 0.0 112.146 -179.205 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.461 HD11 ' HG2' ' A' ' 40' ' ' ARG . 4.9 mp -112.06 -28.96 7.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.486 179.181 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -161.05 118.08 2.31 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.264 179.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.478 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.6 p-10 -113.22 11.76 18.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.111 -179.472 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.2 p -71.21 -37.87 72.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.913 0.387 . . . . 0.0 111.288 -179.678 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.07 160.95 20.84 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.411 0.624 . . . . 0.0 112.344 -179.269 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 36.5 p -55.3 -40.37 71.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.061 178.002 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.536 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 50.7 m95 -92.39 132.67 36.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.819 177.812 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.478 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -106.84 138.67 42.58 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.054 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.476 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 56.2 ttt180 -96.1 129.08 43.48 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.161 177.867 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.652 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.4 p -141.74 159.23 21.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -177.987 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.432 ' CB ' HG23 ' A' ' 48' ' ' THR . 71.3 ttt180 -124.07 141.87 51.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.289 -179.627 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.674 ' HB2' HD22 ' A' ' 21' ' ' LEU . 48.7 t30 -110.12 162.69 14.32 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 120.985 0.422 . . . . 0.0 111.021 179.281 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.01 -19.32 51.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.922 178.608 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.56 5.59 8.79 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.027 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 66.56 26.96 9.76 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.165 0.507 . . . . 0.0 111.105 -179.455 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 57.3 ttm-85 -113.79 125.32 53.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.822 178.957 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.432 HG23 ' CB ' ' A' ' 42' ' ' ARG . 77.6 p -118.51 143.59 46.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.936 0.398 . . . . 0.0 111.554 -179.221 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.55 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -161.06 172.01 37.23 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.75 179.961 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.476 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 95.7 m-85 -104.71 107.87 19.04 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 117.019 0.409 . . . . 0.0 111.995 -179.432 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.421 HG11 ' H ' ' A' ' 21' ' ' LEU . 11.4 m -122.75 120.12 27.85 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.305 178.744 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.536 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 61.7 Cg_endo -73.54 31.59 0.32 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.39 2.06 . . . . 0.0 112.542 178.484 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.411 ' H ' ' C ' ' A' ' 51' ' ' VAL . 86.4 p -61.72 93.95 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 120.997 0.427 . . . . 0.0 111.178 -179.641 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -78.6 -4.85 50.93 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.593 178.321 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.66 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 86.1 m-85 -72.18 -9.77 58.89 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.405 179.22 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 6.9 p -120.2 139.71 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 121.187 0.518 . . . . 0.0 110.614 -179.819 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -144.1 160.21 41.29 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.072 179.88 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 77.9 ttt-85 -69.4 138.57 53.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.928 0.394 . . . . 0.0 110.919 -179.688 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.494 ' HD2' HD11 ' A' ' 8' ' ' ILE . 95.2 mttt . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.839 -179.901 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.1 mtm . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.901 0.382 . . . . 0.0 111.371 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.5 p -79.14 152.37 30.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.945 0.402 . . . . 0.0 111.068 179.96 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -99.22 138.14 36.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.876 179.819 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -97.94 138.64 34.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.165 0.507 . . . . 0.0 111.194 -179.89 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.447 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.0 t -114.4 130.1 69.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.239 179.781 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.438 HG21 ' CD1' ' A' ' 30' ' ' TRP . 8.4 mt -109.88 117.02 53.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.388 -179.743 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 33.1 m -131.94 160.35 42.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.831 0.348 . . . . 0.0 111.157 179.466 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.472 HG12 ' HG2' ' A' ' 28' ' ' ARG . 21.4 mt -117.63 126.66 74.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.844 179.735 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 27' ' ' GLU . . . -74.79 149.68 39.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.147 0.498 . . . . 0.0 110.867 -179.885 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -112.02 -21.43 11.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.948 179.87 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.495 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 20.3 m-90 -139.26 151.3 46.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.838 179.991 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.446 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 57.1 t0 -74.59 125.45 28.67 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.07 0.462 . . . . 0.0 111.196 -178.761 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.464 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 61.2 t80 -128.08 137.5 52.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.942 179.813 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.8 t -103.49 139.28 39.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.651 179.784 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.486 ' CB ' ' HB2' ' A' ' 20' ' ' GLU . . . -57.19 129.81 43.41 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.42 -179.935 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.2 mm-40 -62.85 -33.46 75.3 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.308 0.575 . . . . 0.0 110.186 179.471 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -131.39 161.67 31.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.205 179.739 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -62.03 -33.9 75.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.084 0.469 . . . . 0.0 111.288 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -65.87 -20.16 66.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.202 179.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.528 ' HB3' HG13 ' A' ' 51' ' ' VAL . 2.8 mm-40 -83.32 179.24 7.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 0.0 110.979 -179.663 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.419 HD13 ' ND2' ' A' ' 43' ' ' ASN . 39.8 tp -121.7 126.06 48.09 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.893 -178.547 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -73.18 159.07 34.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.804 179.314 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.464 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 41.5 pt -141.83 166.87 16.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.366 179.807 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 57.1 mttm -114.48 178.67 4.2 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.215 0.531 . . . . 0.0 111.524 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.463 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 20.6 mttp -61.49 -52.31 65.03 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.234 -179.543 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -107.13 -1.36 22.04 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -178.097 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.462 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 79.5 tt0 -62.89 144.43 56.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.233 0.539 . . . . 0.0 111.205 -179.541 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.472 ' HG2' HG12 ' A' ' 8' ' ' ILE . 75.5 mtp180 -100.36 120.82 40.53 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.313 -179.984 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.69 ' HB3' HG22 ' A' ' 41' ' ' VAL . 1.2 mm? -111.65 149.37 31.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.549 -178.758 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.438 ' CD1' HG21 ' A' ' 6' ' ' ILE . 5.2 m-90 -103.91 107.73 18.75 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.126 179.709 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.447 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 88.0 mt -76.23 147.68 38.18 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.031 0.443 . . . . 0.0 111.996 -179.172 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.509 HD11 ' HA ' ' A' ' 41' ' ' VAL . 5.2 mp -109.8 -28.93 8.54 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.596 179.482 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -160.97 117.71 2.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.69 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.497 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.5 p-10 -110.53 3.04 19.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.132 -179.558 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.6 m -63.96 -38.4 90.93 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.772 0.32 . . . . 0.0 111.61 -179.735 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.69 162.76 19.57 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.331 0.586 . . . . 0.0 112.506 -179.075 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.6 p -58.94 -37.23 76.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.244 178.291 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.61 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 68.6 m95 -94.77 131.05 41.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.579 -1.191 . . . . 0.0 108.525 177.959 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.497 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -105.44 137.08 43.84 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.99 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.49 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 69.2 ttt180 -94.61 129.9 41.27 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.048 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.69 HG22 ' HB3' ' A' ' 29' ' ' LEU . 2.4 p -143.29 155.1 16.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 C-N-CA 120.382 -0.527 . . . . 0.0 112.155 -178.384 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 28.4 ttp-105 -123.74 142.2 51.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.912 -179.613 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.419 ' ND2' HD13 ' A' ' 21' ' ' LEU . 43.6 p-10 -111.65 171.66 7.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.676 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.5 -26.72 68.69 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.381 -179.978 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.37 5.4 2.3 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 179.451 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 66.57 25.14 10.08 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.092 0.472 . . . . 0.0 111.026 -179.404 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -110.32 127.8 55.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.598 178.945 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.8 p -121.79 145.63 47.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.724 0.297 . . . . 0.0 110.878 -179.344 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.467 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.92 170.46 39.99 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.996 179.73 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.49 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 90.6 m-85 -101.56 112.45 25.01 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -179.436 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.528 HG13 ' HB3' ' A' ' 20' ' ' GLU . 15.8 m -135.22 116.09 12.05 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.59 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.61 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 63.2 Cg_endo -73.09 45.44 0.95 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.384 2.056 . . . . 0.0 111.903 179.044 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.6 p -70.21 85.22 0.56 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.792 -179.663 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -63.9 -14.6 54.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.008 0.432 . . . . 0.0 110.443 178.724 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.495 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 94.4 m-85 -61.32 -14.6 28.24 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.624 179.367 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.3 p -118.23 140.03 43.19 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 CA-C-O 121.182 0.515 . . . . 0.0 111.201 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -145.5 159.13 43.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.381 179.676 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -71.0 135.2 47.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.839 0.352 . . . . 0.0 110.842 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.054 179.656 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.449 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 79.9 t . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 120.79 0.329 . . . . 0.0 110.377 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 30.3 mm -98.49 114.58 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.16 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.466 HG21 HD11 ' A' ' 31' ' ' LEU . 22.4 m -132.25 165.66 31.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.969 0.414 . . . . 0.0 111.259 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.645 HG23 ' HG2' ' A' ' 28' ' ' ARG . 10.4 mt -128.84 129.02 68.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.51 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.702 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.93 141.14 45.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.605 -178.634 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -105.11 -20.18 13.6 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.746 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.585 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 18.4 m-90 -140.98 150.67 43.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.973 0.416 . . . . 0.0 110.027 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.8 p-10 -69.56 129.72 40.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.216 0.531 . . . . 0.0 112.072 -178.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.411 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 76.6 t80 -127.9 140.58 51.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.772 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.9 t -105.85 138.47 41.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.599 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.539 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -58.91 138.32 57.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.38 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -86.09 -3.26 58.91 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.364 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -146.17 170.15 17.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.708 0.29 . . . . 0.0 110.283 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -74.02 -27.29 60.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.497 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -80.56 -9.71 59.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.611 ' C ' HD12 ' A' ' 21' ' ' LEU . 0.5 OUTLIER -93.26 171.98 8.58 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.758 -179.889 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.611 HD12 ' C ' ' A' ' 20' ' ' GLU . 8.0 mp -120.19 134.88 55.15 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.295 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -74.62 147.0 42.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.424 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.698 HG22 HD11 ' A' ' 29' ' ' LEU . 46.0 pt -127.73 169.4 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.022 179.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -117.34 -176.74 3.07 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.158 0.504 . . . . 0.0 111.85 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -65.85 -37.55 86.5 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.786 -178.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -126.78 39.06 4.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.873 0.368 . . . . 0.0 111.409 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -100.37 132.41 45.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.645 ' HG2' HG23 ' A' ' 8' ' ' ILE . 50.9 mtm105 -88.08 125.7 34.71 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.451 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.698 HD11 HG22 ' A' ' 23' ' ' ILE . 1.1 mm? -116.07 150.31 37.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.824 -178.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 31.1 m-90 -102.62 105.82 16.38 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.442 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.611 HD23 HG23 ' A' ' 41' ' ' VAL . 88.4 mt -79.62 142.55 35.51 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.927 0.394 . . . . 0.0 112.028 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 41' ' ' VAL . 3.9 mp -111.3 -29.11 7.95 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.186 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -158.57 117.6 3.07 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.861 0.363 . . . . 0.0 111.251 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.44 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.4 p-10 -110.56 4.84 20.68 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.2 m -67.79 -36.22 80.05 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.815 0.341 . . . . 0.0 111.326 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -83.54 158.61 21.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.667 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 89.6 m -56.35 -35.22 67.38 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.332 178.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.9 m0 -99.15 133.05 43.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.44 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 42.2 m0 -104.39 134.68 47.19 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.422 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 53.4 ttt180 -86.62 133.08 33.73 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 178.046 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.632 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -137.78 161.49 33.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.02 0.438 . . . . 0.0 111.91 -177.929 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.429 ' CB ' HG22 ' A' ' 48' ' ' THR . 79.8 ttt180 -124.24 149.7 46.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.621 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.408 ' ND2' HD13 ' A' ' 29' ' ' LEU . 1.1 m120 -121.81 160.72 24.05 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.08 0.466 . . . . 0.0 111.488 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.97 -19.83 13.98 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.6 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.99 5.35 11.91 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 72.56 22.74 3.23 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 122.527 0.331 . . . . 0.0 111.452 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.401 ' C ' HD21 ' A' ' 21' ' ' LEU . 95.5 mtt-85 -108.19 146.43 32.78 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.429 HG22 ' CB ' ' A' ' 42' ' ' ARG . 75.6 p -134.95 147.78 49.86 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.846 179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.26 174.72 43.7 Favored Glycine 0 C--N 1.339 0.733 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.29 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 89.4 m-85 -102.59 108.31 19.54 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.544 HG11 ' O ' ' A' ' 21' ' ' LEU . 22.3 m -127.32 115.87 21.52 Favored Pre-proline 0 CA--C 1.533 0.314 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.1 63.65 4.19 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 121.564 1.51 . . . . 0.0 110.968 178.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.713 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.0 OUTLIER -72.98 76.72 1.18 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.516 -178.825 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -60.45 -19.17 55.52 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.208 177.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.585 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 71.5 m-85 -86.91 44.21 1.15 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.004 -0.544 . . . . 0.0 112.122 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 53' ' ' SER . 11.9 p -136.36 146.77 28.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.838 0.352 . . . . 0.0 111.001 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -122.82 140.12 53.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.312 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -75.25 139.97 42.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.854 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.404 ' CE ' ' HB ' ' A' ' 8' ' ' ILE . 51.4 mtmt . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.855 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.7 t . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.96 0.409 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.1 mt -107.32 115.52 48.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.197 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.797 HG12 ' HA ' ' A' ' 58' ' ' ARG . 21.5 m -128.83 161.09 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 111.411 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.579 ' C ' HG23 ' A' ' 56' ' ' VAL . 16.2 mt -119.83 128.72 75.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.12 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.407 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -84.71 117.46 23.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.004 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -90.92 -3.71 57.1 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.515 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 15.9 m-90 -147.08 141.65 26.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.785 0.326 . . . . 0.0 110.377 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.2 p-10 -71.31 120.0 16.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.847 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.414 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 60.9 t80 -127.62 137.11 52.45 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.57 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.6 m -99.93 141.97 32.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.748 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.809 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.48 131.98 51.77 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.792 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -63.72 -30.94 71.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.118 0.485 . . . . 0.0 110.184 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -137.69 160.89 37.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.256 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -59.54 -35.07 73.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.935 0.398 . . . . 0.0 111.169 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -65.19 -20.11 66.29 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.282 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.809 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 3.0 mm-40 -83.79 -179.35 7.27 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.59 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.84 HD23 HG13 ' A' ' 41' ' ' VAL . 24.1 tp -120.57 140.53 51.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.028 0.442 . . . . 0.0 112.085 -178.315 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -84.2 146.45 27.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.65 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.564 HG22 ' HG ' ' A' ' 29' ' ' LEU . 45.3 pt -131.36 160.99 41.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.192 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -116.71 167.24 11.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.073 0.464 . . . . 0.0 111.386 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.441 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 52.1 pttt -67.21 -14.86 63.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.79 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -140.0 22.21 2.44 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.671 -0.411 . . . . 0.0 111.561 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.416 ' HG3' ' CD2' ' A' ' 29' ' ' LEU . 40.4 tp10 -99.67 135.42 41.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.899 0.38 . . . . 0.0 110.516 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.527 ' HG2' HG23 ' A' ' 8' ' ' ILE . 69.2 mtp180 -90.53 120.77 31.9 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.754 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.564 ' HG ' HG22 ' A' ' 23' ' ' ILE . 0.3 OUTLIER -115.69 148.0 40.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.577 -179.601 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -101.62 109.77 21.63 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.079 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.456 ' HA ' HG23 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -81.02 152.63 27.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.383 0.611 . . . . 0.0 112.255 -179.05 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.5 mp -110.93 -25.4 9.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.07 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -160.99 117.41 2.26 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.745 0.307 . . . . 0.0 111.067 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.416 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.5 p-10 -110.8 7.18 21.89 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 86.0 p -74.1 -36.57 64.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.82 0.343 . . . . 0.0 111.371 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -81.1 161.41 24.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.371 0.605 . . . . 0.0 112.31 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.454 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 17.6 p -57.55 -40.5 79.02 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.007 178.191 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.471 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 43.8 m95 -93.94 131.17 39.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.918 177.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.422 ' HB3' HD21 ' A' ' 31' ' ' LEU . 32.0 m0 -102.67 129.68 49.34 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.433 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 44.3 ttt180 -91.78 127.17 37.13 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.595 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.84 HG13 HD23 ' A' ' 21' ' ' LEU . 3.2 p -140.16 161.97 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -177.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.526 ' HA ' HG22 ' A' ' 48' ' ' THR . 59.9 ttt85 -126.23 145.51 50.37 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.723 0.297 . . . . 0.0 111.202 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.469 ' HB2' HD21 ' A' ' 21' ' ' LEU . 61.8 t30 -113.19 161.54 17.04 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.917 0.389 . . . . 0.0 111.824 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.98 -21.05 58.01 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.262 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.65 6.35 15.45 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 68.05 26.07 7.37 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.949 0.404 . . . . 0.0 111.26 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.527 ' O ' HD13 ' A' ' 21' ' ' LEU . 75.0 ttt180 -110.23 123.44 49.78 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.448 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.526 HG22 ' HA ' ' A' ' 42' ' ' ARG . 52.5 p -121.74 156.94 32.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.749 0.309 . . . . 0.0 111.208 -179.113 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.451 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -173.48 171.03 44.18 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.365 -0.922 . . . . 0.0 113.308 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.429 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 90.4 m-85 -103.54 112.53 25.49 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.747 0.308 . . . . 0.0 111.28 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.559 HG13 ' HB3' ' A' ' 20' ' ' GLU . 2.9 m -132.29 114.74 14.85 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.03 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.471 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 8.7 Cg_exo -73.63 36.99 0.4 Allowed 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.721 2.281 . . . . 0.0 113.026 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.466 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -67.69 92.98 0.35 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 120.865 0.364 . . . . 0.0 111.267 -179.584 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -62.17 -17.55 58.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.281 178.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.515 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.0 m-85 -59.93 -14.82 17.48 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.579 HG23 ' C ' ' A' ' 8' ' ' ILE . 8.1 p -112.72 140.44 32.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.083 0.468 . . . . 0.0 110.835 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -136.82 165.24 26.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.064 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.797 ' HA ' HG12 ' A' ' 7' ' ' VAL . 92.0 mtt180 -69.55 139.43 53.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.915 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.7 pttp . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.738 179.977 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.478 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.1 t . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.577 0.227 . . . . 0.0 110.627 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.8 mt -111.67 118.32 57.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.673 0.273 . . . . 0.0 111.709 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.6 HG12 ' HA ' ' A' ' 58' ' ' ARG . 21.4 m -134.11 160.67 41.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.034 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.467 ' HA ' ' HA ' ' A' ' 28' ' ' ARG . 33.6 mt -121.07 124.05 71.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.312 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.76 125.2 28.61 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.932 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.1 mttm -90.99 -9.24 46.72 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.58 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 12.5 m-90 -146.64 145.98 30.24 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.867 0.365 . . . . 0.0 110.876 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -69.91 125.23 26.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.995 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.455 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 65.6 t80 -127.81 141.16 51.65 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.502 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -104.19 136.66 43.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.922 0.392 . . . . 0.0 110.897 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.699 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.26 133.04 54.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.384 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -65.77 -34.27 77.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.187 0.518 . . . . 0.0 110.182 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -131.83 163.94 27.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.329 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -63.52 -31.15 72.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.864 0.364 . . . . 0.0 111.335 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -63.38 -27.25 69.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.301 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.699 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -82.6 -179.19 7.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.27 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.518 HD21 ' O ' ' A' ' 47' ' ' ARG . 6.4 mp -124.73 143.89 50.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.007 0.432 . . . . 0.0 111.345 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -81.44 148.78 29.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.407 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.455 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 49.8 pt -130.96 162.89 38.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.262 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -116.29 171.51 7.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.811 0.339 . . . . 0.0 110.873 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.459 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 16.1 ptpt -69.45 -10.99 60.42 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.7 p-10 -138.46 25.32 2.65 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.714 -0.395 . . . . 0.0 111.366 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.413 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 78.6 tt0 -101.08 139.16 37.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.783 0.325 . . . . 0.0 111.162 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.555 ' C ' HD22 ' A' ' 29' ' ' LEU . 35.8 ptt180 -99.01 121.25 40.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.95 0.405 . . . . 0.0 111.305 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.555 HD22 ' C ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -115.28 153.98 29.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.555 -179.564 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -101.96 112.31 24.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.687 0.28 . . . . 0.0 111.517 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.478 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 40.2 mt -78.19 145.03 35.82 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.928 0.394 . . . . 0.0 111.455 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.8 mp -111.27 -27.09 8.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.324 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -157.52 115.93 3.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.853 0.359 . . . . 0.0 111.038 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.458 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -107.14 4.14 26.5 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.3 t -68.94 -36.66 78.22 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.865 0.364 . . . . 0.0 111.441 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -81.83 159.18 23.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.859 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 86.1 m -59.82 -35.66 75.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.194 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.527 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 8.8 m0 -99.99 125.2 45.99 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.458 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 42.5 m0 -94.96 138.44 32.69 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.429 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 66.6 ttt180 -91.83 137.54 32.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.544 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.555 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -140.4 161.44 24.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.619 -0.433 . . . . 0.0 112.134 -178.146 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.484 ' HB2' HG22 ' A' ' 48' ' ' THR . 46.1 ttp180 -123.48 143.88 49.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.784 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -111.2 162.88 14.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.431 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.9 -19.89 20.23 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.739 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.25 6.0 15.43 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 69.96 24.77 5.05 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-O 120.786 0.327 . . . . 0.0 110.983 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.518 ' O ' HD21 ' A' ' 21' ' ' LEU . 62.7 ttt180 -111.09 128.77 55.99 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.048 179.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.484 HG22 ' HB2' ' A' ' 42' ' ' ARG . 72.8 p -116.91 156.82 26.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.926 0.393 . . . . 0.0 111.16 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.59 178.4 43.91 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.038 -0.601 . . . . 0.0 112.087 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.429 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 97.1 m-85 -106.86 112.31 25.22 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.924 0.392 . . . . 0.0 111.109 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.503 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.7 t -124.54 112.16 27.7 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.658 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.527 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 7.5 Cg_exo -72.9 36.6 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.514 2.143 . . . . 0.0 112.759 178.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' HG12 ' A' ' 56' ' ' VAL . 61.9 p -65.06 97.72 0.26 Allowed 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 120.599 0.238 . . . . 0.0 110.899 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -80.73 -3.68 51.7 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.078 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.58 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 81.1 m-85 -76.74 -1.61 28.88 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 53' ' ' SER . 7.3 p -111.66 142.03 25.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 121.076 0.465 . . . . 0.0 110.859 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -125.86 145.4 50.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.028 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.6 ' HA ' HG12 ' A' ' 7' ' ' VAL . 64.6 mtp180 -69.3 135.69 50.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.962 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.438 ' HD2' HD12 ' A' ' 8' ' ' ILE . 53.2 mttp . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.865 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.6 t . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 120.955 0.407 . . . . 0.0 111.362 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.3 mt -117.54 123.53 71.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.638 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.698 HG12 ' HA ' ' A' ' 58' ' ' ARG . 29.8 m -134.37 159.6 41.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.221 0.534 . . . . 0.0 112.053 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.779 HG23 ' HG2' ' A' ' 28' ' ' ARG . 24.2 mt -117.15 127.13 74.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.093 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.691 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.38 148.72 43.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.95 -179.335 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -113.85 -16.48 12.23 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.589 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.509 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 11.6 m-90 -145.21 148.39 33.48 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.913 0.387 . . . . 0.0 110.325 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -68.49 126.51 29.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.667 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.425 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 45.7 t80 -127.25 135.78 51.09 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.163 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.3 m -105.52 120.77 42.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.026 0.441 . . . . 0.0 110.081 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.514 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -52.92 143.46 16.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.048 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -129.51 40.45 3.59 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.185 0.517 . . . . 0.0 111.473 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.521 ' H ' ' HG2' ' A' ' 20' ' ' GLU . 29.6 mm100 -135.52 176.41 8.7 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.861 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -78.24 -38.68 42.41 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -122.95 77.69 1.48 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.218 0.532 . . . . 0.0 109.94 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.672 ' C ' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -138.95 -179.39 5.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.408 -177.715 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.802 HD11 ' HG2' ' A' ' 47' ' ' ARG . 8.9 mp -137.01 137.39 39.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.101 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.9 p-10 -80.18 150.07 30.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.995 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 46.4 pt -129.44 164.17 32.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 120.655 0.264 . . . . 0.0 110.7 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -112.91 -177.59 3.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.28 0.562 . . . . 0.0 111.451 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -61.44 -52.25 65.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.827 -178.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -105.91 -7.89 17.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.418 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 80.5 tt0 -54.67 146.21 17.3 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.789 0.328 . . . . 0.0 111.515 -179.489 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.779 ' HG2' HG23 ' A' ' 8' ' ' ILE . 82.4 mtm180 -107.32 125.48 51.23 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.446 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.571 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -116.26 156.24 26.94 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.796 0.331 . . . . 0.0 110.738 179.737 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.466 ' O ' HD22 ' A' ' 32' ' ' LEU . 5.7 m-90 -104.68 106.61 17.18 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.647 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.546 ' HA ' HG23 ' A' ' 41' ' ' VAL . 25.9 mt -68.53 143.42 54.94 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.513 0.673 . . . . 0.0 112.13 -178.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.596 HD23 ' HA ' ' A' ' 41' ' ' VAL . 3.9 mm? -112.48 -35.86 5.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.631 -178.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -157.15 115.33 3.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.432 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.444 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 38.4 p-10 -111.99 4.31 18.04 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.3 m -67.47 -39.3 85.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.791 0.329 . . . . 0.0 111.606 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -81.27 159.59 24.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.782 -179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -35.24 68.61 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.473 ' CE3' ' HG3' ' A' ' 52' ' ' PRO . 16.8 m95 -96.22 131.18 42.97 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 177.533 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.472 ' CZ3' HD11 ' A' ' 31' ' ' LEU . 37.7 m0 -104.07 135.44 45.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.168 0.509 . . . . 0.0 112.313 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 49' ' ' GLY . 75.2 ttt180 -94.65 130.29 41.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.596 ' HA ' HD23 ' A' ' 32' ' ' LEU . 1.4 p -137.03 157.3 35.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.443 ' HB2' HD21 ' A' ' 32' ' ' LEU . 37.8 ttm180 -120.55 141.58 50.13 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.075 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -113.18 163.18 15.09 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.676 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.73 -18.94 5.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.17 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.43 6.43 10.24 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 66.05 26.1 10.81 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.052 0.453 . . . . 0.0 111.043 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.802 ' HG2' HD11 ' A' ' 21' ' ' LEU . 56.7 ttp180 -112.32 143.55 43.24 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.463 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.404 HG22 ' CB ' ' A' ' 42' ' ' ARG . 73.1 p -132.76 161.61 33.61 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.791 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.649 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -177.81 -176.34 45.74 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.966 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.438 ' O ' ' HB3' ' A' ' 20' ' ' GLU . 93.6 m-85 -110.69 115.19 29.14 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -178.062 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 51' ' ' VAL . 4.4 m -137.91 112.75 8.97 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.971 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.473 ' HG3' ' CE3' ' A' ' 38' ' ' TRP . 2.7 Cg_exo -74.77 56.35 4.09 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.145 1.897 . . . . 0.0 111.371 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.771 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -73.08 82.24 1.27 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.073 0.463 . . . . 0.0 111.707 -178.83 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -64.64 -14.78 59.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.638 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.509 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.6 m-85 -71.1 -7.17 44.72 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 53' ' ' SER . 9.3 p -110.03 146.58 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.94 0.4 . . . . 0.0 110.888 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -136.59 162.43 33.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.506 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.698 ' HA ' HG12 ' A' ' 7' ' ' VAL . 77.5 mtp180 -69.39 140.89 54.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.771 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.979 179.853 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.495 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 57.9 t . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.744 0.307 . . . . 0.0 110.251 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.1 mt -103.11 119.25 51.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.665 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.665 HG12 ' HA ' ' A' ' 58' ' ' ARG . 35.1 m -132.29 160.24 42.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.564 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.687 ' C ' HG23 ' A' ' 56' ' ' VAL . 26.0 mm -118.48 123.96 72.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.922 0.392 . . . . 0.0 111.329 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.527 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -76.38 120.52 21.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.514 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -93.01 -6.74 47.64 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.594 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 6.8 m-90 -143.99 143.78 31.37 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.796 0.331 . . . . 0.0 110.399 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -71.38 121.66 18.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.048 0.451 . . . . 0.0 111.722 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.433 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 54.2 t80 -127.18 135.52 50.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.692 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.4 m -102.73 141.73 35.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.016 0.436 . . . . 0.0 110.93 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.631 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.76 135.17 51.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.675 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -84.97 -4.87 59.31 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.697 0.284 . . . . 0.0 110.959 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.438 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 74.9 mt-30 -143.9 171.73 13.83 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.468 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -76.37 -28.79 56.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.894 0.378 . . . . 0.0 111.775 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -81.36 -6.7 59.19 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.631 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.1 mt-10 -86.04 179.09 7.04 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.736 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.857 HD23 HG13 ' A' ' 41' ' ' VAL . 28.8 tp -124.27 126.57 46.29 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.997 0.427 . . . . 0.0 111.672 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -68.95 149.51 48.76 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.027 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.597 HG22 ' HG ' ' A' ' 29' ' ' LEU . 46.4 pt -134.88 165.24 31.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.249 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -118.88 166.97 12.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.055 0.455 . . . . 0.0 111.353 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.414 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 55.4 pttt -67.22 -12.56 60.38 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -139.73 21.4 2.5 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.364 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -97.88 141.15 31.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.901 0.381 . . . . 0.0 110.636 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.567 ' HB3' HD12 ' A' ' 8' ' ' ILE . 35.9 ptt-85 -98.72 120.63 39.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.571 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.67 HD22 ' N ' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -113.75 148.17 36.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.032 0.444 . . . . 0.0 111.693 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 15.8 m-90 -99.83 111.31 23.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.979 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.495 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 62.4 mt -72.95 147.32 45.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.809 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.777 HD13 ' HG2' ' A' ' 40' ' ' ARG . 5.2 mp -109.51 -30.89 7.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.415 -179.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -133.72 -66.37 0.64 Allowed 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 120.809 0.338 . . . . 0.0 111.483 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.466 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 3.2 p30 51.6 16.41 0.45 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.621 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.6 m -77.93 -35.87 50.01 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.912 0.387 . . . . 0.0 110.89 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.4 mmtt -92.34 175.3 6.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.646 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.9 m -59.15 -27.86 66.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.723 178.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.489 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 49.4 m95 -99.75 127.64 45.88 Favored 'General case' 0 CA--C 1.522 -0.114 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 177.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.466 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 38.4 m0 -108.23 128.51 54.78 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -176.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.777 ' HG2' HD13 ' A' ' 32' ' ' LEU . 23.5 ttm180 -87.84 135.94 33.17 Favored 'General case' 0 C--O 1.231 0.087 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 177.44 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.857 HG13 HD23 ' A' ' 21' ' ' LEU . 1.4 p -145.36 161.9 12.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.221 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HA ' HG22 ' A' ' 48' ' ' THR . 65.5 ttt180 -120.84 144.06 48.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.009 0.433 . . . . 0.0 111.606 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.855 ' HB2' HD21 ' A' ' 21' ' ' LEU . 55.9 t30 -114.33 161.12 18.31 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.319 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.38 -20.39 29.25 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.816 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.85 6.4 13.24 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 67.69 26.02 7.99 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.062 0.458 . . . . 0.0 111.121 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.633 ' O ' HD13 ' A' ' 21' ' ' LEU . 85.6 mtt-85 -111.72 128.54 56.12 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.647 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.444 HG22 ' HA ' ' A' ' 42' ' ' ARG . 30.5 p -125.61 151.4 46.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.336 -179.201 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.551 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -172.47 172.64 45.04 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.685 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.467 ' CE1' ' HB2' ' A' ' 40' ' ' ARG . 52.6 m-85 -96.75 108.55 21.22 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.48 HG13 ' HB3' ' A' ' 20' ' ' GLU . 4.2 m -126.91 111.36 22.06 Favored Pre-proline 0 C--N 1.333 -0.116 0 CA-C-N 116.794 -0.185 . . . . 0.0 111.208 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.489 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 60.5 Cg_endo -72.23 46.46 0.93 Allowed 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 121.788 1.659 . . . . 0.0 111.733 178.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.68 ' O ' HG12 ' A' ' 56' ' ' VAL . 9.1 p -72.99 81.62 1.21 Allowed 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 120.973 0.416 . . . . 0.0 111.112 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 p30 -58.05 -19.45 31.67 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.113 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.594 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.6 m-85 -57.22 -16.92 9.36 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.724 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.687 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.2 p -108.98 140.57 27.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.045 0.45 . . . . 0.0 110.859 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -135.42 162.56 32.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.026 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.665 ' HA ' HG12 ' A' ' 7' ' ' VAL . 41.1 ttm180 -70.08 139.14 52.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.912 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.3 tttp . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.953 -179.929 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.412 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 53.2 t . . . . . 0 N--CA 1.455 -0.208 0 CA-C-O 120.711 0.291 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.1 mt -109.81 119.79 59.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.249 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.628 HG12 ' CA ' ' A' ' 58' ' ' ARG . 34.1 m -134.03 161.11 41.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.85 0.357 . . . . 0.0 111.244 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.669 HD12 ' HG2' ' A' ' 28' ' ' ARG . 17.2 mm -115.89 121.95 68.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.034 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.573 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -76.12 126.77 31.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.722 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -99.67 -10.6 21.76 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.286 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.596 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.3 m-90 -141.96 145.26 34.3 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.839 0.352 . . . . 0.0 110.462 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -72.53 122.64 21.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.627 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.422 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 55.8 t80 -127.71 139.03 52.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.723 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.3 m -103.14 134.47 46.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.001 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.76 ' HB1' ' HG3' ' A' ' 20' ' ' GLU . . . -56.43 142.26 39.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.965 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -88.75 -4.56 58.49 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -149.45 176.95 10.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.637 0.256 . . . . 0.0 110.662 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -75.78 -34.18 60.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.127 0.489 . . . . 0.0 110.694 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -62.45 -35.98 81.0 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.146 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.894 ' HB2' HG13 ' A' ' 51' ' ' VAL . 0.9 OUTLIER -81.7 178.61 8.23 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.469 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.57 ' O ' HG11 ' A' ' 51' ' ' VAL . 10.2 mp -126.12 161.33 27.88 Favored 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 121.32 0.581 . . . . 0.0 112.093 -178.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -90.53 148.1 22.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.162 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.5 HG22 HD11 ' A' ' 29' ' ' LEU . 40.2 pt -130.06 163.21 36.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.441 ' HB3' ' HB2' ' A' ' 27' ' ' GLU . 86.4 tttt -117.72 164.54 14.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.991 0.424 . . . . 0.0 111.277 -178.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.439 ' N ' ' HG2' ' A' ' 24' ' ' LYS . 11.0 ptpp? -63.31 -12.89 33.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -137.75 5.55 2.64 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 24' ' ' LYS . 77.1 tt0 -77.27 146.79 36.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.753 0.311 . . . . 0.0 110.599 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.669 ' HG2' HD12 ' A' ' 8' ' ' ILE . 86.3 mtm180 -94.96 119.64 33.83 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 120.979 0.418 . . . . 0.0 110.875 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.608 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.6 mm? -113.77 142.41 46.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.468 -179.183 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -103.32 109.63 21.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.695 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.412 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 90.6 mt -79.68 151.12 30.67 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.312 0.577 . . . . 0.0 111.67 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -114.99 -29.01 6.82 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.804 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -161.4 118.36 2.23 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.363 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.456 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.1 p-10 -110.33 2.89 19.38 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.6 m -63.58 -38.9 92.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.955 0.407 . . . . 0.0 111.367 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -82.8 159.49 22.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.675 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.08 -35.6 71.62 Favored 'General case' 0 C--O 1.23 0.065 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.448 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 45.1 m95 -94.85 132.05 40.08 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.456 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 40.1 m0 -105.9 132.47 51.97 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -177.474 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -86.87 131.96 33.96 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.608 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.6 p -140.7 159.56 24.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -177.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.503 ' CB ' HG22 ' A' ' 48' ' ' THR . 44.2 ttm180 -123.79 141.78 51.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.568 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -110.38 162.26 14.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.588 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.36 -19.93 39.57 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.587 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.79 5.01 14.67 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.8 t30 71.88 26.4 2.96 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 110.886 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.443 ' HB2' HD21 ' A' ' 21' ' ' LEU . 99.5 mtt180 -112.47 133.98 54.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.127 179.435 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.503 HG22 ' CB ' ' A' ' 42' ' ' ARG . 73.5 p -124.58 148.1 48.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.901 0.381 . . . . 0.0 111.205 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.715 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -163.23 -178.67 37.17 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.628 -179.468 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 92.0 m-85 -113.27 97.05 6.24 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.894 HG13 ' HB2' ' A' ' 20' ' ' GLU . 0.2 OUTLIER -112.97 121.11 39.13 Favored Pre-proline 0 C--N 1.329 -0.315 0 C-N-CA 121.341 -0.144 . . . . 0.0 110.753 178.288 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.448 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 96.0 Cg_endo -78.26 43.33 1.39 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.018 1.812 . . . . 0.0 111.697 177.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.563 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -71.01 87.84 0.75 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.868 0.366 . . . . 0.0 111.343 -179.292 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -68.32 -11.63 59.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.524 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.596 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 98.7 m-85 -69.09 -10.47 57.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.573 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.3 p -114.86 141.49 31.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.996 0.427 . . . . 0.0 110.691 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -146.88 161.58 40.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.858 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.628 ' CA ' HG12 ' A' ' 7' ' ' VAL . 79.5 ttt-85 -69.84 138.84 52.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.881 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.527 ' HG2' ' HG2' ' A' ' 58' ' ' ARG . 74.6 mmtt . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.916 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.421 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 55.2 t . . . . . 0 N--CA 1.452 -0.327 0 CA-C-O 120.82 0.343 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.0 mm -97.05 118.45 43.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.166 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.833 HG12 ' HA ' ' A' ' 58' ' ' ARG . 30.5 m -134.33 162.86 38.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.184 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.78 HD12 ' HG2' ' A' ' 28' ' ' ARG . 26.8 mm -120.96 130.38 74.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.035 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.18 150.92 38.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.844 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -117.09 -14.17 10.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.748 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.402 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 8.6 m-90 -148.69 149.98 32.4 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.93 0.395 . . . . 0.0 110.962 -179.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -74.18 121.92 21.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.14 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -127.4 137.43 52.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.997 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.3 m -99.76 137.32 38.4 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.287 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.653 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -51.19 129.57 24.64 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.927 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -62.4 -23.74 67.0 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.985 0.422 . . . . 0.0 110.449 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.455 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 96.1 mt-30 -139.47 172.91 12.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.071 179.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -72.8 -29.39 63.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.926 0.393 . . . . 0.0 111.482 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -72.12 -17.46 61.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.911 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.653 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -86.22 179.61 6.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.725 0.298 . . . . 0.0 110.327 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 43' ' ' ASN . 15.3 tp -118.9 143.57 46.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.22 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -86.0 151.66 23.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.654 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 33.7 pt -134.07 162.48 39.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.73 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -114.22 -176.95 3.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.195 0.522 . . . . 0.0 111.24 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 26.1 mttt -63.56 -52.95 58.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.427 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -109.1 -0.17 19.55 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -57.4 142.48 43.65 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.943 0.401 . . . . 0.0 111.404 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.78 ' HG2' HD12 ' A' ' 8' ' ' ILE . 92.5 mtt180 -94.7 122.29 37.16 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.343 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.641 ' HB3' HG21 ' A' ' 41' ' ' VAL . 3.8 mm? -111.38 145.43 38.9 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 26.6 m-90 -105.47 108.44 19.95 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.554 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.535 HD23 HG23 ' A' ' 41' ' ' VAL . 68.1 mt -72.16 147.42 46.63 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.071 0.463 . . . . 0.0 111.891 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.4 mp -112.6 -28.52 7.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.255 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -158.51 116.41 2.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.804 0.335 . . . . 0.0 111.101 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.445 ' OD2' HD13 ' A' ' 31' ' ' LEU . 96.4 m-20 -110.08 9.12 24.15 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.195 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 87.9 p -77.19 -35.13 56.06 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.923 0.392 . . . . 0.0 110.99 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -82.79 157.44 23.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.424 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -58.44 -36.78 74.18 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.428 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 15.2 m95 -95.51 130.17 42.44 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 177.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.422 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 32.3 m0 -100.91 134.41 43.94 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.16 0.505 . . . . 0.0 112.277 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.451 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 73.5 ttt180 -92.79 133.06 36.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 177.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.641 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.2 p -140.48 147.05 23.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.929 -177.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.406 ' CB ' ' HB ' ' A' ' 48' ' ' THR . 58.8 ttt180 -118.54 153.3 34.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.653 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.763 ' HB3' HD21 ' A' ' 21' ' ' LEU . 53.4 p-10 -122.49 171.8 8.83 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.033 0.444 . . . . 0.0 111.808 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.36 -15.08 46.34 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.174 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.88 6.08 10.01 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 66.32 23.18 10.76 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.885 0.374 . . . . 0.0 111.269 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.601 ' O ' HD13 ' A' ' 21' ' ' LEU . 66.9 mtt180 -119.53 129.41 54.67 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.406 ' HB ' ' CB ' ' A' ' 42' ' ' ARG . 5.7 t -135.99 155.85 49.63 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.684 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.528 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.81 -173.66 36.06 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 120.628 -0.796 . . . . 0.0 113.021 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.451 ' HA ' ' HA ' ' A' ' 40' ' ' ARG . 98.1 m-85 -99.66 107.62 19.78 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.69 HG21 ' O ' ' A' ' 21' ' ' LEU . 20.5 t -125.56 119.83 24.6 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.276 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.428 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 77.4 Cg_endo -83.21 39.63 0.84 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.217 1.945 . . . . 0.0 111.733 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.632 ' O ' HG12 ' A' ' 56' ' ' VAL . 25.6 p -68.5 90.05 0.37 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.877 0.37 . . . . 0.0 111.617 -179.075 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -65.94 -13.59 60.04 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.45 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -60.22 -14.4 17.49 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.632 HG12 ' O ' ' A' ' 53' ' ' SER . 7.7 p -111.08 147.16 15.29 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 120.847 0.356 . . . . 0.0 110.759 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -146.07 164.9 30.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.64 -179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.833 ' HA ' HG12 ' A' ' 7' ' ' VAL . 91.9 mtm-85 -68.4 141.86 55.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.332 . . . . 0.0 110.562 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.249 -0.881 . . . . 0.0 110.969 179.959 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 68.5 t . . . . . 0 N--CA 1.456 -0.174 0 CA-C-O 120.743 0.306 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.434 HG23 ' CD1' ' A' ' 30' ' ' TRP . 25.4 mt -112.87 119.0 59.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.848 0.356 . . . . 0.0 111.403 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.618 HG12 ' HA ' ' A' ' 58' ' ' ARG . 34.2 m -132.68 161.65 41.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.07 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.64 ' C ' HG23 ' A' ' 56' ' ' VAL . 30.7 mt -117.43 129.38 74.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.957 0.408 . . . . 0.0 111.339 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.619 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.85 148.29 38.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.362 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -113.31 -17.81 12.21 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.693 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.472 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.9 m-90 -143.62 134.54 25.4 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.965 0.412 . . . . 0.0 111.014 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -60.04 125.32 23.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.626 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -127.54 141.32 51.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.982 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 86.8 m -106.38 138.35 42.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.404 179.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.618 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.92 132.27 49.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.728 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -66.79 -24.67 66.21 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.138 0.494 . . . . 0.0 110.58 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.409 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 96.3 mt-30 -136.12 170.67 15.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.103 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -72.46 -28.11 62.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.79 0.328 . . . . 0.0 111.168 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -69.96 -21.2 63.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.794 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.618 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -82.9 -179.24 7.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.839 0.352 . . . . 0.0 110.556 179.901 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.78 HD21 ' HB3' ' A' ' 43' ' ' ASN . 11.7 tp -118.1 139.92 50.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.323 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -83.54 140.67 32.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.422 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.416 HG22 HD11 ' A' ' 29' ' ' LEU . 32.3 pt -126.56 165.39 24.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.53 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.4 mttm -114.35 -178.68 3.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.12 0.486 . . . . 0.0 111.523 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -64.01 -52.14 60.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.396 -178.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -106.44 -6.42 18.21 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.78 146.75 30.36 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.918 0.39 . . . . 0.0 111.022 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.604 ' HG2' HG23 ' A' ' 8' ' ' ILE . 23.7 mtm105 -101.3 124.86 47.66 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.875 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.533 HD22 ' C ' ' A' ' 28' ' ' ARG . 1.3 mm? -114.32 149.78 35.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.157 0.503 . . . . 0.0 111.644 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.434 ' CD1' HG23 ' A' ' 6' ' ' ILE . 5.2 m-90 -102.17 115.73 31.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.419 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.709 ' C ' HD23 ' A' ' 32' ' ' LEU . 40.6 mt -79.88 146.22 32.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.367 0.603 . . . . 0.0 112.337 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.709 HD23 ' C ' ' A' ' 31' ' ' LEU . 1.7 mt -108.94 -35.0 6.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.308 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -159.61 117.59 2.73 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.11 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.442 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.8 p-10 -107.41 4.94 26.84 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.163 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.9 m -69.11 -36.56 77.67 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.776 0.322 . . . . 0.0 111.696 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -84.06 156.84 22.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.101 0.477 . . . . 0.0 112.035 -179.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 60.2 m -55.75 -31.29 62.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.368 177.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.2 m95 -101.59 134.25 45.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.442 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.5 m0 -103.82 138.01 41.02 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.154 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -97.13 130.45 44.39 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.526 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.5 OUTLIER -139.56 148.62 23.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 120.59 -0.444 . . . . 0.0 112.023 -177.73 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -122.99 146.53 47.54 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.886 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.78 ' HB3' HD21 ' A' ' 21' ' ' LEU . 52.3 p-10 -113.44 171.2 7.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.038 0.447 . . . . 0.0 112.022 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.22 -16.2 31.37 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.991 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.61 5.04 16.61 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 69.93 22.09 6.0 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.75 0.309 . . . . 0.0 111.143 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -116.46 128.62 55.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.11 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.5 t -134.04 151.46 51.43 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.318 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.445 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -160.77 -173.43 29.36 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.807 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -100.06 104.55 16.13 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 111.106 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.57 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.3 t -123.88 112.29 28.84 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.023 179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.8 44.34 1.27 Allowed 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 121.794 1.662 . . . . 0.0 111.437 177.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.648 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.9 p -72.92 81.97 1.2 Allowed 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 120.88 0.371 . . . . 0.0 111.467 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -64.76 -13.36 54.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.338 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.472 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.9 m-85 -62.94 -10.92 15.35 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 53' ' ' SER . 7.3 p -108.82 141.78 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-O 121.05 0.453 . . . . 0.0 111.033 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -130.17 158.46 39.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.651 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.618 ' HA ' HG12 ' A' ' 7' ' ' VAL . 24.3 ttm105 -70.22 129.65 39.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.925 0.393 . . . . 0.0 111.25 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.251 179.723 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.55 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 99.6 t . . . . . 0 C--O 1.233 0.186 0 CA-C-O 120.752 0.31 . . . . 0.0 110.586 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mt -101.08 119.12 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.877 0.37 . . . . 0.0 111.235 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.626 HG12 ' HA ' ' A' ' 58' ' ' ARG . 34.9 m -131.96 163.03 38.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.545 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.647 HG23 ' HG2' ' A' ' 28' ' ' ARG . 47.3 mt -122.89 127.59 74.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.77 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.566 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.08 145.25 44.57 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.952 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -108.83 -18.01 13.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.887 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.533 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 9.7 m-90 -143.87 147.54 34.19 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.844 0.354 . . . . 0.0 111.595 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.495 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 60.5 t0 -69.89 123.14 20.73 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.179 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.425 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 65.1 t80 -128.52 134.88 48.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.666 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 92.6 m -99.5 140.97 32.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.413 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.674 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -53.37 131.49 37.87 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.599 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -67.41 -18.32 65.07 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.384 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.46 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 93.0 mt-30 -142.6 173.7 11.3 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -76.24 -22.27 55.36 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.678 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -82.11 -7.04 59.6 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.674 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.1 mt-10 -92.88 -179.96 5.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.92 0.39 . . . . 0.0 110.744 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.969 HD23 HG13 ' A' ' 41' ' ' VAL . 46.3 tp -116.59 140.51 49.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.554 -178.628 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -85.62 150.06 24.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.837 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 31.2 pt -134.71 164.1 34.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.339 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -116.13 -175.87 2.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.916 0.389 . . . . 0.0 111.486 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.533 ' HD3' ' HA ' ' A' ' 11' ' ' TRP . 13.9 mmtt -64.67 -48.17 75.72 Favored 'General case' 0 C--N 1.334 -0.097 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -112.8 -4.72 13.96 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 73.0 tt0 -58.51 143.03 47.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.905 0.384 . . . . 0.0 111.422 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.647 ' HG2' HG23 ' A' ' 8' ' ' ILE . 90.7 mtt180 -99.74 126.12 45.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.628 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.582 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.3 mm? -114.67 146.45 40.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.002 0.429 . . . . 0.0 111.731 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -103.5 107.03 17.7 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.268 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.55 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 66.3 mt -72.9 148.54 44.26 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.117 0.485 . . . . 0.0 111.652 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -111.97 -29.01 7.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.023 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -158.97 116.97 2.86 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.52 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.454 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 36.6 p-10 -111.26 9.31 21.71 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.2 p -70.28 -36.71 74.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.919 0.39 . . . . 0.0 111.181 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -85.13 155.93 21.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.557 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -35.39 61.36 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.5 m95 -95.62 135.34 37.43 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.454 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 41.9 m0 -109.13 133.17 53.36 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -177.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.433 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 46.4 ttt180 -87.53 134.44 33.61 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.969 HG13 HD23 ' A' ' 21' ' ' LEU . 1.5 p -145.78 157.35 12.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.824 -178.057 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.41 ' CB ' HG22 ' A' ' 48' ' ' THR . 37.8 ttm180 -121.27 143.46 49.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.389 -179.077 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.828 ' HB2' HD21 ' A' ' 21' ' ' LEU . 54.3 t30 -113.49 161.74 16.99 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.372 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.94 -21.33 29.25 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.546 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.76 5.76 10.54 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.9 m120 68.54 23.73 7.24 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 120.841 0.353 . . . . 0.0 111.046 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.509 ' O ' HD13 ' A' ' 21' ' ' LEU . 40.9 ttm180 -108.86 128.54 55.0 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.121 -0.491 . . . . 0.0 109.816 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.41 HG22 ' CB ' ' A' ' 42' ' ' ARG . 81.7 p -119.67 150.41 40.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.067 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.461 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -169.23 171.68 43.14 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.459 -0.876 . . . . 0.0 113.217 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.5 m-85 -102.68 106.37 17.0 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.574 0.225 . . . . 0.0 111.493 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.698 HG11 ' O ' ' A' ' 21' ' ' LEU . 11.1 m -123.08 119.21 27.8 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.327 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -77.31 33.11 0.43 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.147 1.898 . . . . 0.0 112.067 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.8 p -59.1 100.78 0.08 Allowed 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.644 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -81.4 -4.65 56.39 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 177.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -72.65 -7.61 51.21 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.538 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.601 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.7 p -118.81 142.43 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 CA-C-O 120.936 0.398 . . . . 0.0 110.563 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -141.32 161.22 38.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.754 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.626 ' HA ' HG12 ' A' ' 7' ' ' VAL . 27.5 ttm180 -69.93 134.72 48.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.027 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.518 ' HD2' HD12 ' A' ' 8' ' ' ILE . 79.8 tttt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.791 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.481 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.0 t . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 120.722 0.296 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mm -103.21 109.86 28.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.414 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.416 HG12 ' CA ' ' A' ' 58' ' ' ARG . 13.1 m -128.85 162.23 36.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.771 0.319 . . . . 0.0 111.444 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.591 ' C ' HG23 ' A' ' 56' ' ' VAL . 22.8 mt -124.06 122.89 65.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.821 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.59 117.03 17.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.391 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -91.53 -5.35 54.27 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.572 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.2 m-90 -144.65 142.04 29.81 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.906 0.384 . . . . 0.0 110.528 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -70.09 120.39 15.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.584 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.432 ' HB3' HD11 ' A' ' 23' ' ' ILE . 49.4 t80 -127.27 134.13 50.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.556 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.3 m -101.25 141.95 33.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.942 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.662 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.06 135.56 56.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.703 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -83.27 -4.52 58.51 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.074 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.04 168.47 19.93 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.071 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -73.82 -35.34 64.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.443 . . . . 0.0 112.171 -178.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -76.15 -9.72 58.85 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.346 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.662 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -82.4 -178.52 7.09 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.008 0.432 . . . . 0.0 110.855 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.824 HD21 ' HB2' ' A' ' 43' ' ' ASN . 8.9 tp -122.82 138.94 54.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.79 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -83.0 149.08 27.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.439 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.528 HG22 HD11 ' A' ' 29' ' ' LEU . 38.8 pt -134.22 160.8 41.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.332 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 56.0 mtmt -116.0 168.16 10.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.09 0.471 . . . . 0.0 111.32 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.417 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 47.3 pttt -67.36 -11.43 57.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.055 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -141.11 27.24 1.97 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.156 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.422 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 84.8 tt0 -102.44 135.64 43.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.791 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.455 ' C ' HD22 ' A' ' 29' ' ' LEU . 63.6 mtt85 -86.66 119.96 27.46 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.02 0.438 . . . . 0.0 110.852 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.58 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.3 mm? -111.05 143.1 42.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.456 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.476 ' C ' HG23 ' A' ' 41' ' ' VAL . 4.0 m-90 -104.32 105.28 15.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.325 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.481 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 25.3 mt -80.64 148.79 30.09 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.929 0.395 . . . . 0.0 111.091 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.3 mp -110.19 -26.17 9.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.213 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -158.59 115.44 2.79 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.767 0.318 . . . . 0.0 111.042 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 31.9 p-10 -112.24 16.76 19.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.828 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.0 p -78.95 -36.68 41.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.988 0.423 . . . . 0.0 110.976 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -85.29 161.58 19.46 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.771 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 20.7 p -55.74 -41.03 73.34 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.407 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 49.8 m95 -92.48 133.45 35.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.165 178.014 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.44 ' CE3' HD13 ' A' ' 31' ' ' LEU . 38.4 m0 -106.89 132.59 52.67 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -86.97 132.94 33.64 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.58 HG21 ' HB3' ' A' ' 29' ' ' LEU . 4.2 p -149.0 155.32 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -177.676 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.412 ' CB ' HG22 ' A' ' 48' ' ' THR . 80.2 ttt180 -124.07 147.15 48.1 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.942 0.401 . . . . 0.0 111.691 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.824 ' HB2' HD21 ' A' ' 21' ' ' LEU . 39.7 t30 -111.19 164.69 12.61 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.699 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.78 -17.99 61.97 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.677 177.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.501 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -81.18 5.89 15.56 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.011 179.347 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 68.31 25.18 7.15 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.773 0.32 . . . . 0.0 111.713 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.548 ' O ' HD13 ' A' ' 21' ' ' LEU . 82.1 mtt85 -111.56 128.72 56.12 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.412 HG22 ' CB ' ' A' ' 42' ' ' ARG . 77.8 p -117.42 153.87 32.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.967 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.475 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -171.87 168.83 41.96 Favored Glycine 0 CA--C 1.524 0.635 0 C-N-CA 120.512 -0.852 . . . . 0.0 113.567 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -103.33 105.91 16.3 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.593 HG11 ' O ' ' A' ' 21' ' ' LEU . 5.1 m -127.19 112.85 21.56 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 111.604 0.224 . . . . 0.0 111.604 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.407 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 11.8 Cg_exo -71.16 36.23 0.29 Allowed 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 122.6 2.2 . . . . 0.0 112.683 178.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.475 ' OG ' HD11 ' A' ' 23' ' ' ILE . 41.8 t -67.0 93.45 0.28 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.022 0.439 . . . . 0.0 111.897 -178.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -71.07 -9.71 58.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.365 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.572 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.7 m-85 -64.38 -13.34 50.27 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.993 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.591 HG23 ' C ' ' A' ' 8' ' ' ILE . 5.8 p -116.16 143.72 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.12 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -148.56 160.29 43.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.896 0.379 . . . . 0.0 111.357 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.416 ' CA ' HG12 ' A' ' 7' ' ' VAL . 64.4 ttt-85 -72.27 134.81 45.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.4 mttt . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.522 179.134 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.528 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.0 t . . . . . 0 N--CA 1.456 -0.164 0 CA-C-O 120.74 0.305 . . . . 0.0 110.358 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 8.1 mt -103.91 120.39 54.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.388 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.743 HG12 ' CA ' ' A' ' 58' ' ' ARG . 21.0 m -132.41 160.03 42.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.571 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.678 ' C ' HG23 ' A' ' 56' ' ' VAL . 51.7 mt -117.82 122.75 70.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.08 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.512 ' N ' HG23 ' A' ' 56' ' ' VAL . . . -74.84 122.2 23.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.139 0.495 . . . . 0.0 111.71 -178.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -91.39 -2.81 57.21 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.38 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.585 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 8.4 m-90 -145.66 143.51 29.86 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.779 0.323 . . . . 0.0 110.949 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.9 p-10 -72.4 122.71 21.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.198 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.448 ' HE1' HG13 ' A' ' 51' ' ' VAL . 62.4 t80 -128.39 140.47 51.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.17 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.3 m -100.82 136.18 41.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.61 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.792 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -56.97 134.67 55.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.351 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -65.73 -34.33 77.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.086 0.469 . . . . 0.0 110.272 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -128.8 168.38 15.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.233 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -68.01 -34.34 76.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.978 0.418 . . . . 0.0 111.164 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -62.89 -26.26 68.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.085 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.792 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -80.64 -178.68 6.86 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.493 HD12 ' C ' ' A' ' 20' ' ' GLU . 7.3 mp -124.62 145.52 49.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.587 -178.132 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -83.64 149.81 26.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.028 178.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.435 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 43.8 pt -130.79 166.12 29.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.159 179.224 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -120.3 166.76 13.07 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.287 0.565 . . . . 0.0 110.962 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 21.2 pttp -66.61 -12.9 60.1 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.739 -179.256 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -135.4 22.07 3.42 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.208 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -101.08 143.42 31.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.875 0.369 . . . . 0.0 110.592 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.559 ' C ' HD22 ' A' ' 29' ' ' LEU . 26.3 ptt85 -102.86 128.35 49.67 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.935 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.559 HD22 ' C ' ' A' ' 28' ' ' ARG . 0.7 OUTLIER -115.81 151.76 34.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.189 -178.968 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 8.7 m-90 -100.51 110.63 22.81 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.046 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.528 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 86.7 mt -75.41 145.65 41.41 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.946 0.403 . . . . 0.0 111.573 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.607 HD13 ' HG2' ' A' ' 40' ' ' ARG . 5.3 mp -111.69 -29.87 7.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.007 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -161.02 119.86 2.53 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.863 0.363 . . . . 0.0 110.952 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.44 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.4 p-10 -106.44 1.97 26.0 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.3 m -64.9 -39.17 93.11 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -81.32 158.79 24.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.195 0.521 . . . . 0.0 112.192 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 94.2 m -58.64 -36.22 73.77 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.024 178.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.498 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 21.1 m95 -99.37 125.41 45.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.44 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 41.7 m0 -95.11 138.98 32.09 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -177.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.607 ' HG2' HD13 ' A' ' 32' ' ' LEU . 34.9 ttm180 -92.8 136.27 33.39 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 177.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.579 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.8 OUTLIER -141.51 159.68 21.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.834 -178.325 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -121.6 145.06 48.36 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.242 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.445 ' HB2' HD23 ' A' ' 21' ' ' LEU . 52.0 t30 -111.0 162.76 14.53 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.934 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.12 -23.15 45.06 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.852 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.52 5.46 7.32 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 179.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.3 m120 71.33 26.6 3.3 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 120.874 0.369 . . . . 0.0 110.714 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.403 ' C ' HD21 ' A' ' 21' ' ' LEU . 25.9 mmt85 -106.34 145.75 31.28 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.765 178.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.4 p -135.21 148.84 49.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.723 0.297 . . . . 0.0 111.135 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 40' ' ' ARG . . . -171.15 -172.03 36.95 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.851 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -108.89 112.35 24.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.712 0.291 . . . . 0.0 111.419 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.448 HG13 ' HE1' ' A' ' 13' ' ' TYR . 21.7 t -127.09 113.3 21.74 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.416 178.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.498 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 59.9 Cg_endo -76.94 31.11 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.414 2.076 . . . . 0.0 112.484 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.662 ' O ' HG12 ' A' ' 56' ' ' VAL . 13.8 p -62.43 87.24 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.772 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -72.86 -8.12 54.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.517 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.585 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 99.6 m-85 -71.79 -1.29 13.54 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.678 HG23 ' C ' ' A' ' 8' ' ' ILE . 6.5 p -111.04 144.78 18.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-O 120.877 0.37 . . . . 0.0 110.922 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -136.03 148.79 48.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.988 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.743 ' CA ' HG12 ' A' ' 7' ' ' VAL . 78.2 ttt-85 -70.43 138.97 51.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.868 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 62.3 tttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.861 179.638 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.462 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.7 t . . . . . 0 N--CA 1.455 -0.201 0 CA-C-O 120.738 0.304 . . . . 0.0 110.369 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.9 mt -104.5 121.08 55.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.842 0.353 . . . . 0.0 110.939 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.761 HG12 ' HA ' ' A' ' 58' ' ' ARG . 27.2 m -132.34 162.72 39.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.964 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.751 HG23 ' HG2' ' A' ' 28' ' ' ARG . 24.3 mt -116.76 128.46 74.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.642 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.482 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.63 146.75 44.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.037 0.446 . . . . 0.0 111.119 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.419 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 30.9 mtpp -110.25 -21.9 12.01 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.328 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.517 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.9 m-90 -137.47 142.08 41.55 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.164 0.507 . . . . 0.0 110.975 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -65.37 127.1 30.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.535 -179.025 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.467 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 68.0 t80 -128.47 140.24 51.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.707 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.9 m -101.91 134.12 45.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.737 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.788 ' HB1' ' HG3' ' A' ' 20' ' ' GLU . . . -51.87 128.23 23.4 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.35 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -67.82 -24.26 65.27 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.953 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -146.42 171.47 14.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.919 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -67.19 -35.04 78.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.928 0.394 . . . . 0.0 111.585 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -58.17 -40.43 81.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.058 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.788 ' HG3' ' HB1' ' A' ' 15' ' ' ALA . 5.5 pt-20 -83.41 -179.55 7.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.075 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.653 HD21 ' CB ' ' A' ' 47' ' ' ARG . 8.6 mp -122.22 162.26 21.72 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -89.33 144.43 26.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.92 178.393 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.597 HG22 HD11 ' A' ' 29' ' ' LEU . 34.6 pt -128.95 163.98 32.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.815 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.438 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 96.4 mttt -111.94 -179.12 3.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.339 0.59 . . . . 0.0 111.442 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 32.9 ttmt -61.8 -51.99 66.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.808 -179.062 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -105.82 -7.46 18.29 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.438 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 74.9 tt0 -54.03 145.2 17.29 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.036 0.446 . . . . 0.0 111.363 -179.48 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.751 ' HG2' HG23 ' A' ' 8' ' ' ILE . 99.4 mtt180 -101.95 125.87 48.73 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.531 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.676 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.0 OUTLIER -114.6 146.88 40.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.33 -179.165 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -100.91 111.65 23.9 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.172 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.585 HD23 HG23 ' A' ' 41' ' ' VAL . 83.0 mt -76.32 143.73 40.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.758 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.529 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -111.46 -28.25 8.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.909 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -160.97 120.31 2.61 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.116 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.436 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 94.4 m-20 -109.17 5.2 23.69 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.942 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 t -69.62 -35.98 75.74 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.846 0.355 . . . . 0.0 111.427 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -83.23 157.4 22.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.668 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 90.5 m -56.83 -35.78 69.21 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 16.3 m95 -98.89 131.54 44.9 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.436 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 43.5 m0 -101.47 134.25 44.85 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.419 0.525 . . . . 0.0 112.419 -177.378 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.439 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 46.2 ttt85 -88.08 131.81 34.54 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.337 178.393 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.676 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -133.31 163.4 37.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.601 -178.522 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -126.77 140.9 52.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.367 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -108.82 162.99 13.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.823 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.73 -22.75 58.45 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.551 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.76 4.45 9.6 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.9 t30 74.31 24.17 1.91 Allowed 'General case' 0 C--N 1.342 0.258 0 C-N-CA 122.505 0.322 . . . . 0.0 110.952 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.653 ' CB ' HD21 ' A' ' 21' ' ' LEU . 95.4 mtt-85 -105.59 142.83 34.65 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.097 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 78.4 p -132.82 147.05 52.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.803 0.335 . . . . 0.0 111.277 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.476 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -170.31 176.83 43.83 Favored Glycine 0 CA--C 1.523 0.567 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.557 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.439 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 96.1 m-85 -103.13 99.39 9.26 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.075 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.739 HG22 ' HB2' ' A' ' 20' ' ' GLU . 19.8 t -108.1 111.83 61.78 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.294 179.061 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.86 32.93 0.33 Allowed 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.132 1.888 . . . . 0.0 112.448 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.45 ' O ' HG12 ' A' ' 56' ' ' VAL . 15.8 p -65.04 91.69 0.1 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.793 0.33 . . . . 0.0 111.344 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -72.6 -7.4 50.03 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.971 178.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.517 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.4 m-85 -66.81 -10.22 45.48 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.861 0.465 . . . . 0.0 112.231 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.622 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.5 p -115.49 143.63 24.92 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.122 0 CA-C-O 121.025 0.441 . . . . 0.0 110.805 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.28 157.24 46.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.528 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.761 ' HA ' HG12 ' A' ' 7' ' ' VAL . 73.8 ttp85 -79.73 132.08 36.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.95 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.3 mtmm . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.316 -0.849 . . . . 0.0 110.891 179.832 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.529 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 63.5 t . . . . . 0 CA--C 1.53 0.208 0 CA-C-O 120.732 0.301 . . . . 0.0 110.676 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.5 mt -104.07 121.0 55.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.286 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.605 HG12 ' HA ' ' A' ' 58' ' ' ARG . 22.2 m -132.55 162.35 39.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.809 0.338 . . . . 0.0 111.685 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.746 HG23 ' HG2' ' A' ' 28' ' ' ARG . 15.7 mt -123.62 120.61 60.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.85 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.506 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.6 129.24 37.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.643 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -95.32 -6.57 40.93 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.367 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.511 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.1 m-90 -147.34 142.25 26.91 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.848 0.356 . . . . 0.0 110.85 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.43 122.25 20.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.42 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.404 ' CE1' ' O ' ' A' ' 14' ' ' THR . 60.2 t80 -127.46 138.37 52.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.511 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.404 ' O ' ' CE1' ' A' ' 13' ' ' TYR . 27.2 m -98.37 139.63 33.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.9 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.757 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -53.45 128.02 27.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.754 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -61.46 -33.0 73.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.204 0.526 . . . . 0.0 110.426 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -135.76 162.0 33.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.699 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -59.17 -35.69 73.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.918 0.39 . . . . 0.0 111.659 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -66.06 -20.29 66.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.6 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.757 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.3 mm-40 -81.74 -179.83 7.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.948 0.404 . . . . 0.0 110.259 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.744 HD21 ' HB2' ' A' ' 43' ' ' ASN . 9.2 tp -120.21 145.59 46.85 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.681 -178.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -86.71 146.35 26.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.575 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.479 HG22 ' HG ' ' A' ' 29' ' ' LEU . 29.5 pt -131.13 164.29 34.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.106 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -121.59 168.9 11.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.233 0.539 . . . . 0.0 111.067 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.485 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 53.9 pttt -67.1 -15.27 63.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.386 -0.824 . . . . 0.0 113.162 -178.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -139.01 23.61 2.59 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.534 -0.466 . . . . 0.0 111.213 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -99.85 139.1 36.0 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.113 0.482 . . . . 0.0 110.641 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.746 ' HG2' HG23 ' A' ' 8' ' ' ILE . 60.6 mtt85 -92.65 121.43 34.07 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.76 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.507 HD22 ' C ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -113.92 150.07 34.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.875 0.369 . . . . 0.0 110.683 -179.607 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -102.71 113.53 27.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.404 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.529 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 61.0 mt -78.78 143.41 36.12 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.053 0.454 . . . . 0.0 111.28 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -107.82 -28.18 9.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.78 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -159.1 117.05 2.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.947 0.403 . . . . 0.0 110.889 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.448 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.9 p-10 -107.0 1.61 24.53 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.047 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.5 t -67.13 -37.76 84.39 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.88 0.371 . . . . 0.0 111.517 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -81.06 159.51 24.74 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.67 0.748 . . . . 0.0 112.779 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 16.9 p -56.96 -39.9 75.47 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.255 178.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -97.15 132.67 42.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.79 -1.095 . . . . 0.0 108.366 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.448 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 36.1 m0 -102.2 136.66 41.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -177.736 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 44.2 ttt180 -93.49 137.78 32.43 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 177.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.51 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -142.37 162.53 18.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.701 -0.4 . . . . 0.0 111.263 -178.316 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.43 ' HG3' HG22 ' A' ' 48' ' ' THR . 65.7 ttt180 -125.04 143.41 50.93 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.041 0.448 . . . . 0.0 111.891 -178.212 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.744 ' HB2' HD21 ' A' ' 21' ' ' LEU . 59.9 t30 -110.61 164.64 12.53 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.923 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.61 -22.97 64.34 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.804 178.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.97 5.33 11.91 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.043 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 67.82 26.56 7.63 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.95 0.405 . . . . 0.0 111.271 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.537 ' O ' HD13 ' A' ' 21' ' ' LEU . 27.1 ttm180 -110.4 127.65 55.19 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.332 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.43 HG22 ' HG3' ' A' ' 42' ' ' ARG . 37.3 p -122.72 152.62 40.4 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.832 0.349 . . . . 0.0 110.997 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.421 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -168.22 173.1 43.01 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.524 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -100.92 107.16 18.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.916 0.389 . . . . 0.0 111.17 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.724 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.3 t -119.75 113.91 34.39 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.058 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.08 42.81 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 121.804 1.669 . . . . 0.0 111.82 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.472 ' O ' HG12 ' A' ' 56' ' ' VAL . 2.8 p -70.62 88.45 0.69 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.096 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -66.54 -13.98 61.71 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.124 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.511 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.8 m-85 -61.67 -15.45 40.2 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.506 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.4 p -107.07 141.85 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 120.984 0.421 . . . . 0.0 110.451 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -127.44 151.35 48.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.768 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.605 ' HA ' HG12 ' A' ' 7' ' ' VAL . 76.4 mtp180 -69.57 139.9 53.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.836 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.537 ' HZ3' ' HB ' ' A' ' 8' ' ' ILE . 20.1 pttm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.909 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.448 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 77.9 t . . . . . 0 CA--C 1.528 0.121 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.5 mt -115.01 114.42 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.409 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.642 HG12 ' HA ' ' A' ' 58' ' ' ARG . 32.2 m -130.68 163.72 35.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.776 0.322 . . . . 0.0 111.55 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.598 ' C ' HG23 ' A' ' 56' ' ' VAL . 13.7 mt -121.94 121.93 65.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.413 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.601 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -78.45 120.26 22.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.677 -179.618 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -91.11 -7.71 50.88 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.562 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.642 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.8 m-90 -143.57 143.18 31.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.956 0.408 . . . . 0.0 110.705 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -72.08 120.47 17.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.129 0.49 . . . . 0.0 111.751 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.465 ' HB3' HD11 ' A' ' 23' ' ' ILE . 60.1 t80 -128.26 134.7 49.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.766 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.8 m -100.83 138.69 37.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.488 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.649 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -56.54 132.51 51.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.491 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.437 ' HB2' ' OE2' ' A' ' 20' ' ' GLU . 99.0 mm-40 -69.96 -16.06 63.14 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.998 179.191 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -141.64 172.89 12.06 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -74.38 -34.3 63.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.264 0.554 . . . . 0.0 110.533 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.77 -19.13 64.74 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.135 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.649 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -86.4 -179.85 6.74 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.635 -179.264 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.99 HD21 ' HB2' ' A' ' 43' ' ' ASN . 28.6 tp -122.1 130.72 53.5 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -177.18 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -71.23 142.24 50.58 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.194 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.465 HD11 ' HB3' ' A' ' 13' ' ' TYR . 38.1 pt -129.03 164.48 31.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.374 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 66.5 mttm -120.98 167.02 13.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.227 0.537 . . . . 0.0 111.366 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 56.2 pttt -66.84 -12.91 60.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.334 -0.848 . . . . 0.0 113.101 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -141.52 28.35 1.82 Allowed 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 72.5 tt0 -105.09 140.57 38.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.085 0.469 . . . . 0.0 110.928 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.488 ' C ' HD22 ' A' ' 29' ' ' LEU . 66.4 mtp180 -92.46 119.12 31.66 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.184 -179.564 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.551 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.5 mm? -112.23 150.91 30.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.511 -179.402 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -107.2 106.49 16.99 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.612 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.511 ' HA ' HG23 ' A' ' 41' ' ' VAL . 39.3 mt -76.06 149.67 37.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.44 0.638 . . . . 0.0 111.334 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -112.19 -30.43 7.21 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.643 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.1 m-20 -157.04 113.91 3.05 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.529 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.454 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -106.49 2.47 26.29 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -65.18 -37.9 88.8 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 120.843 0.354 . . . . 0.0 111.308 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -82.58 158.21 23.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.545 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -34.59 69.6 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.383 0.611 . . . . 0.0 109.383 178.083 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.475 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 37.4 m95 -96.21 129.84 43.42 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 114.985 -1.007 . . . . 0.0 108.703 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.454 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 38.6 m0 -104.11 132.53 50.27 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -177.313 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -90.03 131.06 36.11 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 177.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.647 HG13 HD23 ' A' ' 21' ' ' LEU . 0.7 OUTLIER -142.5 157.63 19.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.41 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.479 ' CB ' HG22 ' A' ' 48' ' ' THR . 36.5 ttp180 -123.59 141.85 51.61 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.707 -179.028 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.99 ' HB2' HD21 ' A' ' 21' ' ' LEU . 51.7 t30 -113.15 162.45 15.95 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.016 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.03 -18.91 15.85 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.882 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.71 5.27 11.56 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 67.39 26.05 8.49 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-O 120.852 0.358 . . . . 0.0 111.065 -179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -115.25 125.81 53.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.812 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.479 HG22 ' CB ' ' A' ' 42' ' ' ARG . 60.3 p -116.81 151.44 36.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.878 0.371 . . . . 0.0 111.032 -179.437 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.538 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.25 168.38 38.63 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.197 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -102.37 102.65 13.01 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.432 HG13 ' HB3' ' A' ' 20' ' ' GLU . 6.3 m -120.08 122.99 28.59 Favored Pre-proline 0 C--N 1.325 -0.479 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.729 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.475 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 84.2 Cg_endo -80.62 29.28 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.25 1.967 . . . . 0.0 112.333 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.407 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -58.66 91.89 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.3 -179.382 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -68.96 -12.7 61.9 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.059 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.642 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 99.1 m-85 -63.8 -13.79 47.31 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.424 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.601 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.2 p -113.39 142.4 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-O 121.023 0.44 . . . . 0.0 110.579 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -140.61 157.87 44.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.522 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.642 ' HA ' HG12 ' A' ' 7' ' ' VAL . 36.5 ttm180 -69.67 137.74 52.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.9 0.381 . . . . 0.0 110.804 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.4 tttt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.802 -179.78 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.7 t . . . . . 0 N--CA 1.456 -0.151 0 CA-C-O 120.899 0.381 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.5 mt -104.28 116.26 47.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.911 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 58' ' ' ARG . 26.4 m -130.83 163.07 37.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.983 0.42 . . . . 0.0 111.653 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.527 HD12 ' HD2' ' A' ' 59' ' ' LYS . 13.9 mt -123.65 133.49 69.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.019 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.433 ' HB1' HD12 ' A' ' 23' ' ' ILE . . . -80.33 137.01 36.51 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.675 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -102.74 7.45 39.66 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.696 ' CE3' ' HB2' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -163.06 151.18 13.78 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.805 0.336 . . . . 0.0 110.506 178.726 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.421 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 43.3 t0 -79.11 113.68 17.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.031 0.444 . . . . 0.0 111.91 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.492 ' HB2' ' CE2' ' A' ' 11' ' ' TRP . 56.4 t80 -127.57 145.79 50.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.16 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.9 t -105.75 135.22 47.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.373 178.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.722 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -52.75 139.24 27.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.476 . . . . 0.0 112.025 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -64.52 -31.34 72.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.071 0.463 . . . . 0.0 109.817 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -136.73 165.29 26.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.614 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -62.91 -27.89 69.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.861 0.362 . . . . 0.0 110.97 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -68.05 -26.21 65.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.14 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.722 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -89.08 176.92 6.79 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.595 ' O ' HG11 ' A' ' 51' ' ' VAL . 6.7 mp -128.01 141.55 51.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.999 0.428 . . . . 0.0 111.275 -179.294 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.0 p-10 -79.17 157.81 27.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.36 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.649 HG22 ' HG ' ' A' ' 29' ' ' LEU . 44.5 pt -127.93 155.48 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.028 179.262 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 95.4 mttt -111.25 172.45 6.87 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.845 0.355 . . . . 0.0 111.049 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.498 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 19.5 pttp -68.01 -12.96 61.77 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -178.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -151.97 29.38 0.58 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.477 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 59.2 tt0 -98.77 142.06 30.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.84 0.352 . . . . 0.0 110.961 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.507 ' C ' HD22 ' A' ' 29' ' ' LEU . 35.5 mtm-85 -92.3 121.59 33.95 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.404 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.649 ' HG ' HG22 ' A' ' 23' ' ' ILE . 0.6 OUTLIER -116.09 149.02 39.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.713 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -100.42 107.25 18.95 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.964 0.411 . . . . 0.0 110.743 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.576 HD21 ' HB3' ' A' ' 39' ' ' TRP . 0.1 OUTLIER -86.48 152.02 23.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.309 0.576 . . . . 0.0 112.444 -178.651 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.42 HD22 ' NH1' ' A' ' 40' ' ' ARG . 3.2 mp -114.0 -22.38 10.1 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.395 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -163.05 120.61 1.94 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.822 0.344 . . . . 0.0 110.815 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.506 ' HB3' HD22 ' A' ' 31' ' ' LEU . 30.1 p-10 -117.26 19.38 14.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.1 t -81.57 -34.99 30.71 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.741 0.305 . . . . 0.0 111.368 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.4 mmtm -86.87 160.9 18.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.925 0.393 . . . . 0.0 111.624 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 28.8 m -57.09 -33.98 67.85 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 121.352 0.596 . . . . 0.0 109.654 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.434 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 17.5 m95 -99.31 126.38 45.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.587 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.576 ' HB3' HD21 ' A' ' 31' ' ' LEU . 37.7 m0 -99.1 132.06 44.68 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.42 ' NH1' HD22 ' A' ' 32' ' ' LEU . 35.1 ttt180 -88.02 125.78 34.73 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.315 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.569 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.8 p -136.9 162.12 34.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -177.649 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.472 ' HG3' HG22 ' A' ' 48' ' ' THR . 79.1 ttt180 -130.38 148.44 52.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.15 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -117.0 171.52 7.86 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.135 0.493 . . . . 0.0 112.034 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.2 -18.21 60.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.869 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.81 6.47 10.91 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 67.63 24.1 8.59 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 120.899 0.381 . . . . 0.0 111.14 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.578 ' O ' HD21 ' A' ' 21' ' ' LEU . 99.4 mtt180 -111.03 128.37 55.84 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.861 178.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.472 HG22 ' HG3' ' A' ' 42' ' ' ARG . 16.5 p -113.66 159.11 20.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.513 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.506 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -175.1 176.75 47.21 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.18 -1.009 . . . . 0.0 113.347 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 65.2 m-85 -115.99 110.51 19.04 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.595 HG11 ' O ' ' A' ' 21' ' ' LEU . 0.3 OUTLIER -122.99 127.68 25.61 Favored Pre-proline 0 CA--C 1.532 0.251 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.618 178.308 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.434 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 76.7 Cg_endo -76.43 58.6 5.84 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.114 1.876 . . . . 0.0 111.765 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.3 p -66.97 94.36 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -60.42 -60.55 3.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.05 0.452 . . . . 0.0 109.951 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.696 ' HB2' ' CE3' ' A' ' 11' ' ' TRP . 19.5 m-85 -84.35 97.39 9.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 122.582 1.182 . . . . 0.0 113.431 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.1 p -155.45 140.84 10.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.698 177.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -121.43 134.7 55.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.832 0.349 . . . . 0.0 111.679 -178.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.435 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 67.9 ttp85 -78.56 133.42 37.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.867 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.527 ' HD2' HD12 ' A' ' 8' ' ' ILE . 22.1 mttm . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.007 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 30' ' ' TRP . 57.3 t . . . . . 0 N--CA 1.455 -0.187 0 N-CA-C 110.482 -0.192 . . . . 0.0 110.482 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 8.2 mt -106.14 116.71 50.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.766 0.317 . . . . 0.0 111.297 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.528 HG12 ' CB ' ' A' ' 58' ' ' ARG . 34.8 m -131.33 161.21 41.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.215 179.476 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.583 HG23 ' HG2' ' A' ' 28' ' ' ARG . 18.9 mt -122.41 126.3 73.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.78 179.565 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.624 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.77 144.94 41.13 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.941 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -110.14 -25.68 10.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.335 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.491 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 8.3 m-90 -133.36 137.63 45.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -61.98 122.05 14.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.621 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.446 ' HB3' HD11 ' A' ' 23' ' ' ILE . 53.2 t80 -127.09 137.35 53.0 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.648 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.7 m -105.94 137.67 43.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.553 179.511 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.735 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -53.4 142.58 21.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.218 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -88.24 -8.31 55.46 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.272 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -149.12 167.54 25.65 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.646 0.26 . . . . 0.0 110.508 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -68.14 -29.27 68.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.335 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -77.22 -11.33 59.81 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.863 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.735 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -89.69 179.26 6.06 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.86 HD21 ' HB2' ' A' ' 43' ' ' ASN . 44.0 tp -121.7 134.63 54.96 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.026 0.441 . . . . 0.0 111.71 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -77.11 144.47 38.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.853 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.446 HD11 ' HB3' ' A' ' 13' ' ' TYR . 23.1 pt -131.83 164.66 34.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.109 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -113.13 -177.03 3.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.952 0.406 . . . . 0.0 111.284 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -64.91 -51.49 61.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.586 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -109.83 -5.6 15.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -57.05 144.63 33.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.813 0.34 . . . . 0.0 111.25 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.583 ' HG2' HG23 ' A' ' 8' ' ' ILE . 81.8 mtm180 -97.63 124.35 41.88 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.63 179.509 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.655 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.8 mm? -111.59 147.13 36.12 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.895 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.41 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 6.2 m-90 -104.33 104.24 14.1 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.144 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.915 HD11 ' HB3' ' A' ' 39' ' ' TRP . 0.5 OUTLIER -72.23 147.63 46.3 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.3 0.572 . . . . 0.0 112.259 -179.057 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.2 mp -109.82 -26.68 9.68 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.976 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -160.99 118.16 2.33 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.808 0.337 . . . . 0.0 111.257 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.44 ' OD2' ' HG ' ' A' ' 31' ' ' LEU . 97.0 m-20 -105.61 3.62 29.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.159 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 57.7 m -68.57 -35.36 77.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.708 0.289 . . . . 0.0 111.721 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -85.68 156.48 20.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.257 0.551 . . . . 0.0 112.264 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 58.6 m -57.72 -31.8 66.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.188 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.485 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 7.4 m0 -100.26 132.99 45.32 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.915 ' HB3' HD11 ' A' ' 31' ' ' LEU . 23.5 m0 -100.69 128.97 46.55 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -176.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.805 ' O ' HD13 ' A' ' 31' ' ' LEU . 72.6 ttt180 -87.94 122.82 32.01 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.084 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.812 HG13 HD23 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -138.45 151.09 24.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 120.475 -0.49 . . . . 0.0 112.219 -177.835 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.451 ' CB ' ' HB ' ' A' ' 48' ' ' THR . 24.4 ttp-105 -121.92 146.72 46.85 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.3 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.86 ' HB2' HD21 ' A' ' 21' ' ' LEU . 57.6 t30 -116.05 164.6 14.22 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.363 -179.275 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.38 -18.26 16.72 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.867 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.89 4.78 11.11 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.3 t30 72.64 21.59 3.48 Favored 'General case' 0 C--N 1.339 0.116 0 CA-C-O 120.859 0.361 . . . . 0.0 111.302 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.457 ' O ' HD13 ' A' ' 21' ' ' LEU . 95.6 mtt180 -114.8 130.49 56.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.905 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.451 ' HB ' ' CB ' ' A' ' 42' ' ' ARG . 12.2 t -141.34 143.17 33.87 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.778 -179.468 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.455 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.47 178.64 39.64 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.371 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.4 m-85 -93.38 113.17 25.28 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.632 0.253 . . . . 0.0 111.512 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.516 HG13 ' HB3' ' A' ' 20' ' ' GLU . 4.6 m -127.46 120.94 22.21 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.846 -0.161 . . . . 0.0 111.263 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.485 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 6.3 Cg_exo -72.33 30.92 0.27 Allowed 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.421 2.081 . . . . 0.0 112.091 177.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.456 ' O ' HG12 ' A' ' 56' ' ' VAL . 8.4 t -66.0 85.51 0.09 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 120.897 0.379 . . . . 0.0 111.135 -179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 p30 -69.09 -9.97 55.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.422 178.252 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.491 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 80.9 m-85 -65.2 -10.63 33.03 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.624 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.6 p -115.03 141.48 31.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.909 0.385 . . . . 0.0 110.735 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -137.73 150.4 47.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.725 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.528 ' CB ' HG12 ' A' ' 7' ' ' VAL . 67.7 ttt180 -69.53 140.5 53.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.802 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 93.2 mttt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.243 -0.884 . . . . 0.0 111.051 179.968 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.424 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 59.3 t . . . . . 0 N--CA 1.452 -0.325 0 CA-C-O 120.761 0.315 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.1 mt -114.06 118.38 58.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.117 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.735 HG12 ' HA ' ' A' ' 58' ' ' ARG . 32.9 m -131.39 162.53 39.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 121.048 0.452 . . . . 0.0 111.623 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.642 HG23 ' HG2' ' A' ' 28' ' ' ARG . 10.5 mt -120.02 123.6 71.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.503 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.657 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.5 126.5 31.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.202 -179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -96.47 -10.35 27.65 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.336 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.63 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.6 m-90 -145.12 143.14 30.22 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.792 0.329 . . . . 0.0 110.577 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -67.8 125.51 26.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.096 0.474 . . . . 0.0 111.62 -178.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.467 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 58.2 t80 -127.8 138.12 52.62 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.844 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.7 t -102.74 140.28 37.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.913 0.387 . . . . 0.0 110.714 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.631 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -61.45 136.24 57.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.474 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -84.39 -3.58 58.39 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.085 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.472 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 92.8 mt-30 -145.47 171.65 14.33 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.586 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -76.44 -29.84 57.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.935 0.398 . . . . 0.0 111.283 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -75.99 -12.65 60.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.937 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.631 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -88.74 178.02 6.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.933 0.397 . . . . 0.0 110.726 -179.697 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.615 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.5 mp -124.88 139.52 53.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.77 -178.347 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -78.6 146.41 34.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.354 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.467 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 45.8 pt -129.84 161.87 38.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.473 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -114.72 166.32 11.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.768 0.318 . . . . 0.0 111.025 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.463 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 21.0 pttp -63.75 -11.32 25.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -138.45 25.95 2.62 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.289 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.439 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 83.9 tt0 -99.57 138.01 37.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.854 0.359 . . . . 0.0 110.903 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.642 ' HG2' HG23 ' A' ' 8' ' ' ILE . 75.8 mtp180 -94.1 120.67 34.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.124 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.601 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -115.21 150.06 36.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.04 -179.351 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.0 m-90 -103.43 107.15 17.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.172 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.459 ' HA ' HG23 ' A' ' 41' ' ' VAL . 89.3 mt -76.69 149.15 36.44 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.051 0.453 . . . . 0.0 111.561 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.0 mp -113.97 -28.63 7.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.036 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -160.99 118.88 2.4 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.552 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.444 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 31.3 p-10 -110.87 2.8 18.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.128 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.0 m -65.06 -36.82 85.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.828 0.347 . . . . 0.0 111.342 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -83.63 158.75 21.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.083 0.468 . . . . 0.0 111.809 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.7 m -57.44 -34.78 69.32 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.564 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 61.3 m95 -97.64 131.61 44.06 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 177.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.479 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 40.5 m0 -103.94 133.79 48.31 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -177.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.422 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 37.4 ttt180 -88.58 130.1 35.33 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.633 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.601 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.7 OUTLIER -141.04 155.52 21.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 120.915 0.388 . . . . 0.0 111.589 -178.702 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.458 ' HB2' HG22 ' A' ' 48' ' ' THR . 40.3 ttp180 -120.42 145.58 47.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.605 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -113.04 162.56 15.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.703 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.16 -21.33 46.7 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.879 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.34 5.23 10.96 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.857 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.0 t30 72.81 24.68 2.63 Favored 'General case' 0 N--CA 1.46 0.071 0 CA-C-O 120.829 0.347 . . . . 0.0 110.895 -179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.491 ' O ' HD21 ' A' ' 21' ' ' LEU . 82.5 mtm180 -108.92 136.89 47.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.434 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.458 HG22 ' HB2' ' A' ' 42' ' ' ARG . 74.8 p -124.81 152.7 43.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.729 0.299 . . . . 0.0 110.905 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -174.23 179.87 45.3 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.56 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.479 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 95.3 m-85 -110.11 113.54 26.32 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.808 0.304 . . . . 0.0 111.618 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.615 HG11 ' O ' ' A' ' 21' ' ' LEU . 29.4 m -131.21 112.02 15.59 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.587 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.564 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 74.0 Cg_endo -74.73 45.24 1.25 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.18 1.92 . . . . 0.0 111.855 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.717 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.4 p -69.61 73.63 0.38 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.038 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -53.57 -19.18 3.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.935 0.398 . . . . 0.0 110.93 178.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.63 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 77.5 m-85 -61.11 -12.83 13.66 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.221 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.717 HG12 ' O ' ' A' ' 53' ' ' SER . 11.9 p -110.36 146.15 15.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-O 120.808 0.337 . . . . 0.0 110.943 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.419 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 85.5 tt0 -142.21 164.17 30.88 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.544 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.735 ' HA ' HG12 ' A' ' 7' ' ' VAL . 18.8 mtp180 -68.69 139.28 55.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.528 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.6 tttp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.343 -0.836 . . . . 0.0 110.864 179.938 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.456 ' HB ' ' HB3' ' A' ' 31' ' ' LEU . 64.1 t . . . . . 0 CA--C 1.531 0.244 0 CA-C-O 120.726 0.298 . . . . 0.0 110.382 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.3 mm -100.41 110.97 28.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.807 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.754 HG12 ' HA ' ' A' ' 58' ' ' ARG . 34.6 m -128.49 155.91 40.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.767 0.318 . . . . 0.0 111.348 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.57 HD12 ' HG2' ' A' ' 28' ' ' ARG . 30.6 mm -121.29 126.98 75.68 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.874 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.564 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.96 143.14 45.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.496 -179.536 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.429 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 60.3 mttp -112.42 -24.34 9.8 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.753 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.6 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.3 m-90 -137.1 136.7 38.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.045 0.45 . . . . 0.0 110.552 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -59.74 120.8 10.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.394 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.516 ' HB3' HD11 ' A' ' 23' ' ' ILE . 49.3 t80 -127.22 138.39 53.1 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.144 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 86.6 m -107.06 139.64 41.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.657 179.474 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.574 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.22 135.54 56.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.713 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -87.75 0.32 55.9 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.542 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.467 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 95.8 mt-30 -147.11 167.23 24.63 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -75.05 -20.28 59.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.577 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -88.47 -8.19 55.32 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.574 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -88.54 177.53 6.76 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.658 -179.757 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.947 HD23 HG13 ' A' ' 41' ' ' VAL . 38.6 tp -119.44 128.66 54.23 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -70.4 141.69 52.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.9 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.516 HD11 ' HB3' ' A' ' 13' ' ' TYR . 35.9 pt -130.65 162.59 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.253 179.411 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 88.3 mttt -110.95 -177.27 3.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.901 0.381 . . . . 0.0 110.767 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HG3' ' HA ' ' A' ' 11' ' ' TRP . 27.6 ttpp -65.3 -48.76 72.01 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.626 -178.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -114.61 -0.25 13.71 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.443 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 66.3 tt0 -57.62 144.11 38.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.105 0.479 . . . . 0.0 111.175 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.57 ' HG2' HD12 ' A' ' 8' ' ' ILE . 89.1 mtt180 -91.49 121.67 33.39 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.467 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.726 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.7 mm? -115.28 140.65 48.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.344 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -100.89 105.26 16.51 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.793 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.672 HD11 ' HB3' ' A' ' 39' ' ' TRP . 5.6 tp -84.1 151.34 24.99 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 mp -107.92 -19.32 13.56 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.757 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -168.82 125.12 0.95 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.787 0.327 . . . . 0.0 111.326 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.418 ' HB3' HD23 ' A' ' 31' ' ' LEU . 34.1 p-10 -115.58 2.18 13.73 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.682 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.2 m -64.13 -38.33 90.65 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.791 0.329 . . . . 0.0 111.623 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -82.9 159.01 22.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.002 0.429 . . . . 0.0 111.746 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.8 m -58.94 -35.58 73.36 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.476 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 22.6 m95 -94.59 127.67 40.69 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.434 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.672 ' HB3' HD11 ' A' ' 31' ' ' LEU . 41.5 m0 -102.06 134.45 45.27 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -177.194 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.454 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 53.6 ttt180 -92.38 125.81 37.19 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.931 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.947 HG13 HD23 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -139.2 161.79 28.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -178.514 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.637 ' CB ' HG22 ' A' ' 48' ' ' THR . 53.7 ttp180 -125.81 147.58 49.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.042 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.922 ' HB3' HD21 ' A' ' 21' ' ' LEU . 47.3 p-10 -118.6 172.25 7.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.012 0.434 . . . . 0.0 111.762 -179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.37 -23.43 65.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.541 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.36 4.97 9.57 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 68.98 25.68 5.89 Favored 'General case' 0 N--CA 1.457 -0.093 0 CA-C-O 120.815 0.34 . . . . 0.0 111.012 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 55.3 mtp180 -111.09 132.46 54.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.692 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.637 HG22 ' CB ' ' A' ' 42' ' ' ARG . 80.6 p -123.49 148.28 46.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.923 -179.579 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.454 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.2 168.69 40.58 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.39 -0.909 . . . . 0.0 113.142 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.454 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 96.9 m-85 -101.14 103.91 14.98 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.722 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 20' ' ' GLU . 4.7 m -117.4 119.93 33.91 Favored Pre-proline 0 C--N 1.33 -0.26 0 C-N-CA 121.214 -0.194 . . . . 0.0 111.385 178.791 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.476 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 72.6 Cg_endo -74.84 41.63 0.75 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.356 2.038 . . . . 0.0 111.6 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.471 ' O ' HG12 ' A' ' 56' ' ' VAL . 80.2 p -71.07 89.93 0.83 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.586 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -66.44 -13.23 60.48 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.589 -0.445 . . . . 0.0 110.166 178.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.6 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.5 m-85 -64.11 -12.96 44.29 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.564 HG23 ' HA ' ' A' ' 9' ' ' ALA . 9.4 p -114.6 140.9 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 121.129 0.49 . . . . 0.0 110.848 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -133.78 163.25 29.89 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.418 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.754 ' HA ' HG12 ' A' ' 7' ' ' VAL . 71.6 ttt-85 -80.21 135.74 36.33 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.47 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.684 179.786 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.463 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.7 t . . . . . 0 CA--C 1.531 0.214 0 CA-C-O 120.796 0.331 . . . . 0.0 110.402 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -98.67 112.32 30.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.352 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.762 HG12 ' CA ' ' A' ' 58' ' ' ARG . 35.4 m -131.58 162.28 39.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.045 0.45 . . . . 0.0 111.835 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.59 ' C ' HG23 ' A' ' 56' ' ' VAL . 33.5 mt -120.18 124.58 72.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.851 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.613 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.61 120.43 20.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.061 0.458 . . . . 0.0 111.481 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -92.96 -9.49 39.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.842 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.645 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.3 m-90 -141.86 142.24 33.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.87 0.366 . . . . 0.0 110.85 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -72.43 123.15 22.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.462 -179.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.445 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 57.8 t80 -127.53 137.77 52.72 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.53 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.01 135.13 41.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.941 ' HB1' ' HG3' ' A' ' 20' ' ' GLU . . . -61.91 136.84 58.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.032 0.444 . . . . 0.0 111.795 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -86.53 0.14 54.91 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.313 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.474 ' HB2' ' HG2' ' A' ' 20' ' ' GLU . 96.7 mt-30 -153.69 162.0 41.64 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.914 0.387 . . . . 0.0 110.992 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -64.75 -40.21 94.93 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.242 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -61.01 -31.3 70.92 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.918 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.941 ' HG3' ' HB1' ' A' ' 15' ' ' ALA . 6.1 pt-20 -86.47 175.5 8.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.12 -179.417 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.714 ' O ' HG11 ' A' ' 51' ' ' VAL . 10.6 mp -128.88 158.88 37.52 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -176.187 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -86.97 149.67 24.61 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.884 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.611 HG22 HD11 ' A' ' 29' ' ' LEU . 47.6 pt -130.68 161.05 41.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.798 178.43 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 64.6 mttm -115.9 166.54 11.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.253 0.549 . . . . 0.0 111.437 -179.423 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 54.9 pttt -66.37 -11.24 50.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.781 -179.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -140.54 25.35 2.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.406 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 82.3 tt0 -100.94 140.0 35.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.101 0.477 . . . . 0.0 110.69 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 -91.69 119.57 31.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.824 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.636 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.2 mm? -110.55 143.59 40.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.419 -178.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 29.4 m-90 -98.78 106.01 18.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.985 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.463 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 73.0 mt -75.64 148.77 38.48 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.489 0.662 . . . . 0.0 111.823 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.596 HD23 ' HA ' ' A' ' 41' ' ' VAL . 3.6 mm? -115.27 -35.52 4.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.896 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -160.68 116.96 2.31 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.753 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.444 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -109.99 3.81 20.79 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.0 t -66.63 -39.24 88.19 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.799 0.333 . . . . 0.0 111.289 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -82.66 159.15 22.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.641 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.0 -34.75 68.46 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 121.417 0.627 . . . . 0.0 109.38 178.437 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.467 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 63.4 m95 -96.18 130.03 43.34 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.458 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 39.6 m0 -104.4 127.3 52.06 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.405 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.44 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 66.8 ttt180 -84.9 126.88 33.86 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.636 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -134.69 161.92 39.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.102 0.477 . . . . 0.0 111.87 -178.671 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.413 ' CB ' HG22 ' A' ' 48' ' ' THR . 41.6 ttm180 -123.66 151.31 43.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.891 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.401 ' OD1' HD13 ' A' ' 29' ' ' LEU . 34.0 m-20 -119.68 168.57 10.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.813 0.34 . . . . 0.0 111.246 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.19 67.73 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.382 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.86 4.56 9.52 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.1 t30 72.44 24.06 3.02 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.819 0.343 . . . . 0.0 111.093 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.48 ' CB ' HD21 ' A' ' 21' ' ' LEU . 81.2 mtp180 -106.09 135.5 47.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.413 HG22 ' CB ' ' A' ' 42' ' ' ARG . 77.0 p -124.66 157.58 35.21 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.21 -179.398 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.687 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -174.02 174.27 46.25 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 120.303 -0.951 . . . . 0.0 113.105 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.458 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 84.7 m-85 -107.2 97.0 6.82 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -178.54 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.815 HG13 ' HB2' ' A' ' 20' ' ' GLU . 0.8 OUTLIER -115.26 116.91 41.66 Favored Pre-proline 0 N--CA 1.469 0.51 0 CA-C-O 119.622 -0.228 . . . . 0.0 111.361 177.839 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.467 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 73.9 Cg_endo -76.63 44.4 1.4 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.243 1.962 . . . . 0.0 111.464 177.396 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.52 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.8 OUTLIER -70.26 80.08 0.53 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -59.49 -17.28 30.37 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.554 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.645 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 85.7 m-85 -59.82 -12.51 7.57 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.613 HG23 ' HA ' ' A' ' 9' ' ' ALA . 8.6 p -109.6 143.73 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 120.939 0.399 . . . . 0.0 110.96 179.527 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 55.6 mp0 -143.38 161.22 38.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.583 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.762 ' CA ' HG12 ' A' ' 7' ' ' VAL . 77.8 ttt180 -71.01 140.51 50.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.125 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.4 tttt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.753 179.312 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 30' ' ' TRP . 93.2 t . . . . . 0 C--O 1.223 -0.298 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.423 HG12 ' CD1' ' A' ' 30' ' ' TRP . 41.5 mt -114.49 115.88 50.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.771 0.32 . . . . 0.0 110.847 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.669 HG12 ' CA ' ' A' ' 58' ' ' ARG . 34.9 m -130.77 159.68 42.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.129 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.625 HD12 ' HG2' ' A' ' 28' ' ' ARG . 16.4 mm -114.93 125.71 72.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.59 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.526 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.05 145.17 42.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.802 0.334 . . . . 0.0 110.862 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -112.75 -23.7 10.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.477 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.58 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.8 m-90 -134.21 139.76 46.02 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.975 0.417 . . . . 0.0 110.593 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -66.68 121.22 14.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.282 -178.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.442 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 47.3 t80 -126.25 136.56 52.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.694 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.5 m -103.34 145.56 29.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.841 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.773 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.28 138.92 54.18 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.276 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -84.54 -9.3 58.45 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.975 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.438 ' HB2' ' HG2' ' A' ' 20' ' ' GLU . 74.9 mt-30 -150.75 168.78 23.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.235 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -67.08 -34.0 76.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.893 0.378 . . . . 0.0 111.64 -179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -77.66 -6.03 52.45 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.019 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.773 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -87.74 179.04 6.57 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.801 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.959 HD23 HG13 ' A' ' 41' ' ' VAL . 43.7 tp -121.32 119.12 31.27 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.107 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -68.32 141.47 55.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.266 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.472 HG22 HD11 ' A' ' 29' ' ' LEU . 14.9 pt -128.14 165.52 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.981 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 60.2 mttt -114.09 -179.12 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.215 0.531 . . . . 0.0 111.057 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.429 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 36.5 ttpt -64.53 -48.14 76.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.804 -178.823 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -113.09 2.57 15.74 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.482 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 71.3 tt0 -60.53 148.19 38.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.122 0.487 . . . . 0.0 111.363 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.625 ' HG2' HD12 ' A' ' 8' ' ' ILE . 84.6 mtm180 -94.54 121.32 35.96 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.946 179.46 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.673 ' HB3' HG21 ' A' ' 41' ' ' VAL . 3.6 mm? -114.58 137.79 51.45 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.454 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.489 ' C ' HG23 ' A' ' 41' ' ' VAL . 6.3 m0 -101.3 106.01 17.15 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.982 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.446 HD11 ' CZ3' ' A' ' 39' ' ' TRP . 81.3 mt -78.58 154.53 30.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.488 0.661 . . . . 0.0 111.94 -179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.0 mp -117.09 -29.19 6.01 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.808 179.227 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -158.98 116.65 2.82 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.203 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.489 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 40.2 p-10 -111.14 10.45 21.91 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.5 t -74.2 -35.24 63.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.878 0.371 . . . . 0.0 111.432 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmtp -84.4 159.62 20.79 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.794 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 87.9 m -59.27 -32.97 70.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.422 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.451 ' CD1' ' N ' ' A' ' 38' ' ' TRP . 2.8 m95 -96.74 130.95 43.89 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.489 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 32.5 m0 -103.36 135.85 44.22 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -177.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.442 ' HG2' HD13 ' A' ' 32' ' ' LEU . 28.3 ttm180 -96.7 127.86 43.09 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.959 HG13 HD23 ' A' ' 21' ' ' LEU . 3.8 p -143.55 156.62 16.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.962 -177.422 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -122.84 143.18 50.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.049 0.452 . . . . 0.0 111.68 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.548 ' CG ' HD21 ' A' ' 21' ' ' LEU . 43.0 m-20 -107.37 161.67 14.6 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.236 179.661 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.98 -24.28 64.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.197 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.67 2.64 11.46 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.357 -0.383 . . . . 0.0 112.032 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.2 t30 73.93 24.38 2.07 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.678 0.275 . . . . 0.0 111.042 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -109.39 129.71 55.53 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.308 -0.406 . . . . 0.0 109.956 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.1 p -125.15 161.58 26.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.694 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 178.6 169.73 39.71 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.997 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -97.49 108.76 21.54 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.788 0.328 . . . . 0.0 111.689 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.559 HG13 ' HB3' ' A' ' 20' ' ' GLU . 9.6 m -132.3 114.17 14.69 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.64 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -70.77 44.5 0.51 Allowed 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 121.858 1.706 . . . . 0.0 111.761 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.525 ' O ' HG12 ' A' ' 56' ' ' VAL . 85.6 p -70.57 76.91 0.58 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 121.045 0.45 . . . . 0.0 110.506 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -60.14 -17.97 44.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.638 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.58 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 83.0 m-85 -58.86 -15.5 12.87 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.593 HG23 ' C ' ' A' ' 8' ' ' ILE . 4.5 p -112.95 141.12 29.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-O 121.001 0.429 . . . . 0.0 110.676 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -142.96 162.57 35.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.088 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.669 ' CA ' HG12 ' A' ' 7' ' ' VAL . 29.5 ttm180 -70.96 140.59 50.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.772 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.965 -179.907 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.4 t . . . . . 0 C--O 1.225 -0.229 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.4 mt -104.15 112.97 39.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.438 0.161 . . . . 0.0 111.312 -179.805 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.695 HG12 ' CA ' ' A' ' 58' ' ' ARG . 32.1 m -128.15 162.72 33.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 120.794 0.331 . . . . 0.0 111.469 179.315 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.725 HD12 ' HG2' ' A' ' 28' ' ' ARG . 19.3 mm -120.01 120.07 62.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.586 -179.382 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.429 ' N ' HG23 ' A' ' 56' ' ' VAL . . . -76.4 119.65 20.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.745 179.664 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -92.48 -8.37 44.79 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.037 -179.759 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.444 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 7.3 m-90 -142.49 142.4 32.27 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.789 0.328 . . . . 0.0 110.859 -179.594 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -71.56 122.59 20.76 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.046 0.45 . . . . 0.0 110.95 -178.916 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.45 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 58.4 t80 -127.8 137.08 52.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.943 -179.908 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.6 m -103.77 139.06 39.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.653 179.599 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.71 136.73 50.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.575 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -91.18 1.51 57.04 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.441 178.776 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.514 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 99.3 mt-30 -142.74 166.23 25.23 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.219 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -75.82 -20.9 57.81 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.136 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -90.16 -5.51 56.37 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -179.486 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.558 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -87.25 -179.46 6.42 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.051 0.453 . . . . 0.0 111.499 -179.565 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.957 HD21 ' HB2' ' A' ' 43' ' ' ASN . 14.2 tp -124.1 130.67 52.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.526 -178.069 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -72.82 147.54 45.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.467 179.303 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.558 HG22 HD11 ' A' ' 29' ' ' LEU . 37.2 pt -132.2 164.3 35.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.647 179.503 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 59.9 mttt -118.06 167.09 11.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.158 0.504 . . . . 0.0 110.975 179.808 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 52.6 pttt -66.45 -11.52 52.41 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.931 -179.575 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -141.78 27.73 1.82 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.965 0.412 . . . . 0.0 110.903 179.542 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.511 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 82.0 tt0 -99.69 140.7 33.5 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.208 0.528 . . . . 0.0 111.04 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.725 ' HG2' HD12 ' A' ' 8' ' ' ILE . 76.2 mtm180 -89.16 119.28 29.52 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.712 -179.928 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.733 ' HB3' HG21 ' A' ' 41' ' ' VAL . 3.0 mm? -115.23 139.9 49.55 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.806 -178.165 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.56 ' C ' HG23 ' A' ' 41' ' ' VAL . 5.5 m-90 -103.83 104.42 14.42 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.308 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.468 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 33.6 mt -77.56 142.22 39.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.259 0.552 . . . . 0.0 112.05 -178.932 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -105.02 -26.7 12.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.04 -179.899 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -159.03 115.12 2.62 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.803 0.335 . . . . 0.0 110.788 179.739 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.422 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 88.6 m-20 -108.18 4.67 25.06 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.061 -179.746 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.4 p -71.19 -34.32 70.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.967 0.413 . . . . 0.0 111.026 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -83.78 158.14 21.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.716 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 81.3 m -59.32 -33.04 70.64 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.195 178.285 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.447 ' N ' ' CD1' ' A' ' 38' ' ' TRP . 5.5 m95 -98.74 131.7 44.68 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 177.554 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 35.9 m0 -103.87 130.94 51.5 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -177.404 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.447 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 39.6 ttt85 -88.09 136.4 32.99 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 177.601 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.733 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.4 p -150.36 155.17 7.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.831 -178.879 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.508 ' HG3' HG22 ' A' ' 48' ' ' THR . 48.4 ttp180 -121.4 144.2 48.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.075 -179.709 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.957 ' HB2' HD21 ' A' ' 21' ' ' LEU . 43.8 t-20 -110.41 164.45 12.68 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.062 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.13 -25.4 65.45 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.256 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.26 3.72 8.36 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 179.382 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 73.96 24.36 2.06 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 120.749 0.309 . . . . 0.0 110.819 -179.621 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.4 mtm180 -108.05 131.56 54.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.069 179.52 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.508 HG22 ' HG3' ' A' ' 42' ' ' ARG . 30.6 p -126.34 147.86 49.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.144 -179.472 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.458 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.22 167.3 39.77 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.806 179.861 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.447 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.2 m-85 -99.63 106.44 18.39 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 117.082 0.441 . . . . 0.0 112.182 -179.23 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.525 HG13 ' HB3' ' A' ' 20' ' ' GLU . 14.0 m -124.94 114.47 26.54 Favored Pre-proline 0 CA--C 1.534 0.342 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 179.19 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.98 35.4 0.27 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 122.027 1.818 . . . . 0.0 112.211 177.698 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.472 ' O ' HG12 ' A' ' 56' ' ' VAL . 7.5 t -67.93 81.46 0.21 Allowed 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 120.861 0.362 . . . . 0.0 110.426 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -57.11 -19.12 17.9 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.146 0.498 . . . . 0.0 110.626 178.375 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.434 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 91.8 m-85 -54.58 -16.52 2.47 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.728 179.447 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.599 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.6 p -115.69 140.49 37.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 120.958 0.408 . . . . 0.0 111.147 179.826 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -145.54 161.91 38.67 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.891 -179.909 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.695 ' CA ' HG12 ' A' ' 7' ' ' VAL . 67.5 ttp85 -72.48 142.15 48.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.902 179.805 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 94.3 mttt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.671 179.443 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.506 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 60.4 t . . . . . 0 N--CA 1.455 -0.217 0 CA-C-O 120.741 0.305 . . . . 0.0 110.733 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.473 HG12 ' HD1' ' A' ' 30' ' ' TRP . 24.6 mt -102.6 120.61 52.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.08 -179.98 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.676 HG12 ' HB3' ' A' ' 58' ' ' ARG . 27.2 m -129.62 164.98 30.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.164 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.625 ' C ' HG23 ' A' ' 56' ' ' VAL . 26.2 mt -123.14 123.8 68.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.687 179.545 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.483 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.9 120.51 21.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.346 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -90.04 -7.21 54.45 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.814 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.548 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 5.3 m-90 -144.48 143.25 30.78 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.819 0.343 . . . . 0.0 111.342 -179.604 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -70.45 121.58 18.03 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.548 179.952 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.47 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 63.6 t80 -127.66 140.13 52.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.966 0.412 . . . . 0.0 111.397 -179.476 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 75.0 m -102.21 137.97 39.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.683 179.674 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.583 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.8 139.23 54.5 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.488 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -89.93 -0.01 57.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.299 179.1 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.496 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 94.2 mt-30 -147.23 163.85 35.05 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 179.225 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -70.59 -24.72 62.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 111.814 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -82.91 -15.51 51.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.271 -0.422 . . . . 0.0 112.115 -179.142 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.583 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -85.88 177.53 7.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.097 0.475 . . . . 0.0 110.431 179.749 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.654 ' O ' HG21 ' A' ' 51' ' ' VAL . 8.2 mp -129.43 142.41 50.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.489 -179.471 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -77.92 155.67 30.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.803 179.914 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.47 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 50.6 pt -133.55 165.02 33.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.478 179.59 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 40.0 mttp -115.76 165.73 12.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.062 0.458 . . . . 0.0 111.146 -179.652 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.548 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 22.4 pttp -64.97 -14.14 59.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.629 -179.328 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -138.92 25.72 2.51 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.189 179.738 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 80.8 tt0 -100.77 138.54 37.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.104 0.478 . . . . 0.0 110.967 -179.95 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.519 ' C ' HD22 ' A' ' 29' ' ' LEU . 82.6 mtm180 -94.1 123.17 37.3 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.927 -179.853 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.692 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -115.72 150.2 37.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.889 0.376 . . . . 0.0 111.1 -179.668 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.473 ' HD1' HG12 ' A' ' 6' ' ' ILE . 7.5 m-90 -101.38 111.73 24.04 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.267 179.917 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.506 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 72.0 mt -74.84 148.56 40.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.945 0.402 . . . . 0.0 111.416 -179.794 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.4 mp -111.31 -27.22 8.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.67 179.454 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -161.87 118.38 2.09 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.595 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.457 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 35.0 p-10 -110.02 6.76 23.29 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.655 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.0 p -71.87 -35.5 69.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.957 0.408 . . . . 0.0 111.212 -179.715 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -83.63 157.56 22.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.715 -179.491 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.8 m -57.32 -35.52 69.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.199 178.315 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -97.5 128.54 44.34 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.6 177.854 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.457 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 42.2 m0 -99.03 140.23 33.5 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -177.903 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.545 ' HG2' HD13 ' A' ' 32' ' ' LEU . 47.8 ttt180 -99.56 134.47 42.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.075 -0.966 . . . . 0.0 108.778 178.081 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.692 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.5 OUTLIER -136.53 161.92 36.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.924 0.392 . . . . 0.0 111.8 -178.455 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.463 ' HB2' HG22 ' A' ' 48' ' ' THR . 37.9 ttp-105 -126.5 143.06 51.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.091 179.658 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.537 ' ND2' ' HB3' ' A' ' 45' ' ' ALA . 44.4 p-10 -110.81 169.39 8.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.55 -179.452 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.85 -22.57 64.36 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.355 179.827 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.537 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . . . -73.73 5.79 3.72 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.793 179.214 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 67.58 22.65 9.09 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 121.015 0.436 . . . . 0.0 110.957 -179.264 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -109.43 137.97 46.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.306 179.335 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.463 HG22 ' HB2' ' A' ' 42' ' ' ARG . 52.2 p -121.52 161.56 22.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.752 0.311 . . . . 0.0 110.988 -179.803 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.33 174.77 47.24 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.692 -179.876 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.532 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 95.6 m-85 -107.7 111.23 23.33 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.783 0.325 . . . . 0.0 111.386 -179.684 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.654 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.5 t -122.41 109.54 32.89 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.189 179.609 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.05 32.64 0.27 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.214 1.943 . . . . 0.0 112.313 178.876 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.541 ' HB2' HG12 ' A' ' 51' ' ' VAL . 8.8 t -72.93 87.01 1.31 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 120.948 0.404 . . . . 0.0 111.065 -179.675 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -67.14 -8.66 32.67 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.757 178.649 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -63.34 -10.08 14.86 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.856 179.418 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.625 HG23 ' C ' ' A' ' 8' ' ' ILE . 5.6 p -118.05 142.11 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-O 120.895 0.378 . . . . 0.0 110.801 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.412 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 84.8 tt0 -147.04 159.56 43.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.824 -179.712 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.676 ' HB3' HG12 ' A' ' 7' ' ' VAL . 29.4 ptt180 -71.43 144.44 49.75 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.798 0.332 . . . . 0.0 111.18 179.836 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.9 tttt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.19 -0.909 . . . . 0.0 110.716 179.341 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.477 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 58.4 t . . . . . 0 N--CA 1.453 -0.277 0 CA-C-O 120.678 0.275 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.1 mt -115.35 119.28 61.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.167 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.733 HG12 ' HA ' ' A' ' 58' ' ' ARG . 28.0 m -132.16 161.13 41.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.08 179.477 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 28.0 mm -116.55 127.85 74.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.435 179.534 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.23 148.18 39.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -179.669 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 63.6 mttp -113.6 -16.83 12.29 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.671 179.951 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.532 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 16.1 m-90 -142.42 137.97 30.75 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.102 0.477 . . . . 0.0 110.655 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -63.62 123.74 19.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.035 -178.863 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.49 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 55.5 t80 -127.89 139.55 52.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.63 -179.613 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.15 138.62 40.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.191 179.212 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.74 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.27 127.42 29.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.445 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.41 ' OE1' ' CZ3' ' A' ' 38' ' ' TRP . 96.0 mt-30 -62.36 -35.02 77.82 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.148 0.499 . . . . 0.0 110.367 179.678 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -129.3 162.0 28.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.097 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -61.89 -34.66 76.44 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.014 0.435 . . . . 0.0 111.157 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -63.11 -24.75 68.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.444 -179.823 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.74 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.3 mm-40 -81.04 -179.58 7.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.117 0.485 . . . . 0.0 110.131 179.621 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.76 HD21 ' HB3' ' A' ' 43' ' ' ASN . 6.9 tp -119.42 144.58 46.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.517 -178.524 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -85.31 143.57 28.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.761 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.497 HD11 ' OG ' ' A' ' 53' ' ' SER . 38.8 pt -131.0 162.92 38.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.651 179.539 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 72.0 mmtt -110.97 176.2 5.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.163 0.506 . . . . 0.0 111.064 179.691 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.517 ' HG3' ' HA ' ' A' ' 11' ' ' TRP . 28.6 ttpp -63.08 -45.91 89.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.841 -178.827 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -109.76 -0.25 18.55 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.505 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 78.5 tt0 -64.63 145.3 56.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.423 0.63 . . . . 0.0 111.19 -179.405 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.448 ' C ' HD22 ' A' ' 29' ' ' LEU . 22.4 ptt-85 -99.26 121.96 41.77 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.533 -179.992 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.738 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.0 mm? -113.38 146.55 39.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.555 -179.099 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.411 ' C ' HG23 ' A' ' 41' ' ' VAL . 4.4 m-90 -102.11 108.35 19.73 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.268 179.804 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.477 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 83.8 mt -75.04 150.75 38.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.033 0.444 . . . . 0.0 111.638 -179.517 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -112.63 -28.43 7.82 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.664 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -160.99 118.47 2.36 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.853 0.359 . . . . 0.0 110.768 179.763 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.484 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 32.7 p-10 -106.84 1.23 24.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.282 -179.765 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.4 m -63.9 -37.36 87.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.889 0.376 . . . . 0.0 111.687 -179.435 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -81.91 158.67 23.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.148 -179.133 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.7 m -58.96 -37.01 75.78 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 177.919 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.41 ' CZ3' ' OE1' ' A' ' 16' ' ' GLN . 26.7 m95 -96.37 129.35 43.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.51 177.697 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.484 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 36.2 m0 -99.21 138.78 35.82 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.825 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.448 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 69.7 ttt180 -97.04 132.77 42.51 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.188 178.378 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.738 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.1 p -140.83 155.91 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.143 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.554 ' HG3' HG22 ' A' ' 48' ' ' THR . 37.4 ttm180 -125.23 140.16 53.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.69 -179.282 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.76 ' HB3' HD21 ' A' ' 21' ' ' LEU . 47.6 p-10 -108.92 172.13 7.03 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.174 0.512 . . . . 0.0 111.749 179.687 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.2 -24.34 67.16 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.168 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.598 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -73.36 3.47 5.88 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 179.472 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.6 t30 69.57 24.96 5.42 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 120.861 0.362 . . . . 0.0 111.28 -179.89 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.598 ' NH1' ' HB1' ' A' ' 45' ' ' ALA . 81.5 mtt85 -112.98 136.07 53.06 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.087 179.133 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.554 HG22 ' HG3' ' A' ' 42' ' ' ARG . 31.4 p -125.0 156.76 37.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.042 0.449 . . . . 0.0 111.704 -179.026 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -173.26 173.16 45.61 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.458 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.448 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.7 m-85 -102.66 110.12 21.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.882 0.372 . . . . 0.0 110.462 179.836 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.533 HG21 ' O ' ' A' ' 21' ' ' LEU . 13.1 t -121.98 110.14 33.27 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.658 -179.737 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -73.99 35.87 0.39 Allowed 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 121.824 1.682 . . . . 0.0 112.46 177.959 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.576 ' O ' HG12 ' A' ' 56' ' ' VAL . 23.1 t -68.54 87.52 0.32 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.826 0.345 . . . . 0.0 111.074 -179.44 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -59.83 -18.33 43.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.188 0.518 . . . . 0.0 110.062 177.54 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.532 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.9 m-85 -56.0 -17.05 5.78 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.657 179.589 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.576 HG12 ' O ' ' A' ' 53' ' ' SER . 7.1 p -113.07 142.98 23.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 CA-C-O 121.047 0.451 . . . . 0.0 110.86 -179.821 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.409 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 86.2 tt0 -141.86 159.94 41.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.766 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.733 ' HA ' HG12 ' A' ' 7' ' ' VAL . 78.8 mtp180 -69.59 141.62 53.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.835 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.721 179.58 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.48 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.8 t . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.728 0.299 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.6 mm -98.42 117.38 43.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.994 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.806 HG12 ' CA ' ' A' ' 58' ' ' ARG . 34.1 m -135.12 162.3 38.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.145 0.498 . . . . 0.0 112.05 -179.699 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.591 ' C ' HG23 ' A' ' 56' ' ' VAL . 15.4 mt -122.51 124.08 69.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.798 -179.464 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.614 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -76.59 119.94 21.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.073 0.463 . . . . 0.0 111.702 -179.491 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -91.56 -7.68 49.56 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.169 -179.769 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.72 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 15.9 m-90 -142.41 143.74 32.8 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.919 0.39 . . . . 0.0 110.536 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.7 p-10 -74.16 121.54 21.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.364 -179.13 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.447 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 60.9 t80 -127.91 138.22 52.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.67 179.914 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.3 t -101.41 142.57 32.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.768 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.776 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -58.03 132.42 53.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.836 -179.717 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.408 ' OE1' ' CH2' ' A' ' 38' ' ' TRP . 92.8 mt-30 -66.75 -30.38 70.58 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 121.131 0.491 . . . . 0.0 110.244 179.165 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -132.66 161.42 33.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.125 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -62.29 -31.95 72.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.895 0.379 . . . . 0.0 111.9 -179.163 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -71.17 -15.39 62.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.72 -179.744 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.776 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.4 mm-40 -84.79 -178.97 7.0 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.356 -179.388 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.883 HD21 ' HB2' ' A' ' 43' ' ' ASN . 13.1 tp -125.79 123.87 39.73 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -177.884 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -68.43 152.67 45.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.716 179.401 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.447 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 45.5 pt -133.98 162.13 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.098 179.249 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -117.11 164.84 14.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.285 0.564 . . . . 0.0 111.22 -179.934 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 52.0 pttt -64.54 -13.49 52.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.954 -179.591 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -140.72 24.77 2.21 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.331 179.643 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.556 ' HG2' HD22 ' A' ' 29' ' ' LEU . 80.5 tt0 -102.25 135.64 43.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.158 0.504 . . . . 0.0 110.871 179.845 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.487 ' HG2' HG23 ' A' ' 8' ' ' ILE . 87.0 mtm-85 -89.49 120.71 31.05 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.69 179.984 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.61 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.8 mm? -110.95 145.89 37.57 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.131 -177.792 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 27.1 m-90 -99.73 105.05 16.81 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.611 0.243 . . . . 0.0 111.216 179.173 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.48 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 96.1 mt -76.22 148.63 37.53 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.116 0.484 . . . . 0.0 111.2 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.559 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -112.77 -32.38 6.43 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.624 179.902 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -156.99 114.72 3.17 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.396 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.458 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 29.9 p-10 -109.27 1.79 20.4 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -179.035 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.4 m -65.02 -36.02 83.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.876 0.37 . . . . 0.0 111.584 -179.626 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -82.42 158.33 23.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.509 0.671 . . . . 0.0 112.488 -179.042 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 20.1 p -55.58 -39.42 70.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.354 178.112 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.408 ' CH2' ' OE1' ' A' ' 16' ' ' GLN . 28.8 m95 -93.26 133.28 36.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.759 -1.11 . . . . 0.0 108.285 177.24 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.458 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 33.9 m0 -105.48 131.35 53.01 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -177.871 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.465 ' HG2' HD13 ' A' ' 32' ' ' LEU . 29.6 ttp180 -91.06 133.11 35.58 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.753 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.61 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.7 p -143.61 159.72 16.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 C-N-CA 120.268 -0.573 . . . . 0.0 112.257 -177.554 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.727 ' HA ' HG22 ' A' ' 48' ' ' THR . 44.2 ttp180 -119.57 152.65 36.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.456 -179.08 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.883 ' HB2' HD21 ' A' ' 21' ' ' LEU . 58.4 t30 -120.46 159.73 24.55 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.749 0.309 . . . . 0.0 111.058 179.418 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.56 -21.34 52.47 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.849 178.765 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.424 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -80.45 5.7 14.37 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.171 179.19 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.8 m120 70.07 22.28 5.75 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 122.592 0.357 . . . . 0.0 111.311 -179.249 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.424 ' NH1' ' HB1' ' A' ' 45' ' ' ALA . 82.7 mtt85 -109.16 127.31 54.09 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.055 178.808 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.727 HG22 ' HA ' ' A' ' 42' ' ' ARG . 63.4 p -123.12 151.06 42.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.148 -179.61 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.439 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.57 174.9 40.63 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.561 179.856 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -105.16 110.88 23.43 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 117.0 0.4 . . . . 0.0 111.93 -179.436 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.56 HG13 ' HB3' ' A' ' 20' ' ' GLU . 16.0 m -132.46 115.45 14.85 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.12 178.661 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.35 43.58 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.773 1.649 . . . . 0.0 111.966 178.878 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.7 m -63.76 97.07 0.14 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.019 0.438 . . . . 0.0 110.462 -179.78 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -72.24 -15.67 61.93 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.498 179.093 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.72 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 89.2 m-85 -69.1 -10.47 57.79 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.452 -179.536 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.614 HG23 ' HA ' ' A' ' 9' ' ' ALA . 9.2 p -113.24 139.73 37.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 O-C-N 121.732 -0.605 . . . . 0.0 110.781 179.358 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -144.94 160.05 41.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.357 -179.81 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.806 ' CA ' HG12 ' A' ' 7' ' ' VAL . 36.9 ptt-85 -70.13 137.2 50.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.266 -179.475 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 61.9 tttm . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.744 179.81 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.53 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 56.0 t . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 120.737 0.303 . . . . 0.0 110.511 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.402 HG12 ' HD1' ' A' ' 30' ' ' TRP . 22.8 mt -104.73 121.01 56.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.825 179.816 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.677 HG12 ' HB3' ' A' ' 58' ' ' ARG . 25.5 m -132.72 161.07 42.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.97 0.414 . . . . 0.0 111.781 -179.798 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.705 ' C ' HG23 ' A' ' 56' ' ' VAL . 16.9 mt -120.99 128.05 76.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.005 -179.918 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -77.64 127.26 32.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.004 -179.988 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -93.74 -13.31 27.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.449 179.596 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.475 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 7.3 m-90 -140.58 154.12 46.37 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-O 120.999 0.428 . . . . 0.0 111.311 -179.699 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.473 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 11.4 t70 -76.58 123.82 26.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.525 -179.493 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.477 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 63.3 t80 -127.97 140.36 52.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.157 -179.776 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.1 m -104.19 138.02 41.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.703 179.571 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.61 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -59.0 138.03 57.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.784 -179.814 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -86.77 -0.27 56.06 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.455 178.703 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.531 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 78.1 mt-30 -147.75 167.42 24.73 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.135 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -73.67 -29.97 62.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.007 0.432 . . . . 0.0 111.361 -179.638 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -76.25 -14.94 60.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.208 -179.393 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.61 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -85.79 178.08 7.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.915 0.388 . . . . 0.0 111.04 -179.467 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.57 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.6 mp -124.85 141.64 51.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.3 0.572 . . . . 0.0 111.481 -178.19 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -80.77 147.78 30.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.746 179.615 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.477 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 47.0 pt -129.2 164.88 30.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.222 179.228 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 68.8 mttm -116.5 176.78 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.18 0.514 . . . . 0.0 112.037 -179.095 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.475 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 28.1 mttt -61.7 -30.17 70.57 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.838 -179.871 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -133.78 53.34 2.01 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.064 0.459 . . . . 0.0 110.903 -179.483 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.452 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 80.2 tt0 -117.08 137.69 52.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.038 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.53 ' HG2' HG12 ' A' ' 8' ' ' ILE . 94.0 mtm-85 -96.77 122.79 40.11 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.197 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.713 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -117.04 147.88 41.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.081 -179.873 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.402 ' HD1' HG12 ' A' ' 6' ' ' ILE . 5.2 m-90 -99.99 106.53 18.33 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.209 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.53 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 80.0 mt -76.24 146.39 39.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.094 0.473 . . . . 0.0 111.633 -179.401 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -111.69 -30.51 7.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.753 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -161.01 120.13 2.57 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.474 179.548 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.48 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.1 p-10 -110.84 1.54 17.74 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -179.46 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.7 m -63.41 -39.04 93.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.741 0.305 . . . . 0.0 111.532 -179.576 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -81.72 158.82 24.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.007 0.432 . . . . 0.0 111.656 -179.511 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.9 -35.01 68.49 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.077 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.602 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 61.2 m95 -96.92 129.38 44.38 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.453 177.668 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.495 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 39.4 m0 -104.17 132.71 50.14 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -177.662 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.572 ' HG2' HD13 ' A' ' 32' ' ' LEU . 65.5 ttt180 -87.92 134.12 33.78 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.592 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.713 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.2 p -139.73 161.22 27.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.761 -178.796 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.46 ' CB ' HG22 ' A' ' 48' ' ' THR . 42.9 ttm180 -125.54 142.01 51.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.837 -179.715 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -111.88 165.63 11.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.471 -179.523 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.69 -27.67 65.04 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.448 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -72.8 5.11 3.42 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.886 179.191 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.6 m120 69.23 25.68 5.61 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.002 0.43 . . . . 0.0 111.058 -179.659 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.548 ' O ' HD21 ' A' ' 21' ' ' LEU . 21.8 ttt180 -110.72 131.5 55.0 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.221 179.227 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.46 HG22 ' CB ' ' A' ' 42' ' ' ARG . 75.7 p -119.73 156.87 29.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.146 -179.818 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.46 177.7 44.94 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.103 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.567 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.0 m-85 -108.73 115.01 29.28 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.464 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.57 HG11 ' O ' ' A' ' 21' ' ' LEU . 12.6 m -128.59 110.32 19.06 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.601 179.407 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.602 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 57.9 Cg_endo -72.41 32.41 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.406 2.071 . . . . 0.0 112.218 178.481 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.462 ' O ' HG12 ' A' ' 56' ' ' VAL . 11.7 t -68.4 84.81 0.27 Allowed 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.471 -179.917 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -64.65 -11.3 33.92 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.866 178.743 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -62.93 -9.84 11.32 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 179.591 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.705 HG23 ' C ' ' A' ' 8' ' ' ILE . 6.2 p -117.91 139.1 46.37 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-O 121.022 0.439 . . . . 0.0 110.679 179.663 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -142.54 161.9 36.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.624 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.677 ' HB3' HG12 ' A' ' 7' ' ' VAL . 33.2 ptt-85 -71.14 141.12 50.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.875 0.369 . . . . 0.0 111.218 -179.803 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.6 tttt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.142 -0.932 . . . . 0.0 110.671 179.551 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.416 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.0 t . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 120.71 0.291 . . . . 0.0 110.553 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.2 mt -115.37 118.38 58.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.333 -179.647 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.722 HG12 ' HA ' ' A' ' 58' ' ' ARG . 29.1 m -132.14 160.21 42.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.941 0.4 . . . . 0.0 111.278 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.553 ' C ' HG23 ' A' ' 56' ' ' VAL . 35.3 mt -116.75 126.87 74.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.472 179.577 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.585 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.0 149.83 39.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.587 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -112.37 -20.65 11.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.183 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.514 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 16.4 m-90 -140.42 150.58 44.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.641 -179.944 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.48 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 50.9 t0 -72.97 124.57 25.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.346 -179.322 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 57.1 t80 -127.52 133.89 49.81 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.577 179.621 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.5 m -101.51 139.15 37.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.047 0.451 . . . . 0.0 111.104 -179.804 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.796 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.23 129.72 39.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.693 -179.905 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -65.53 -31.8 73.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.118 0.485 . . . . 0.0 110.008 179.345 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -130.99 163.81 26.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.114 179.623 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -64.61 -34.69 78.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.97 0.414 . . . . 0.0 111.266 -179.622 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.1 -19.39 65.96 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.444 -179.882 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.796 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 -82.63 -178.93 7.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.65 0.262 . . . . 0.0 111.175 -179.803 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.946 HD21 ' HB2' ' A' ' 43' ' ' ASN . 26.1 tp -120.79 134.44 55.29 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.161 0.505 . . . . 0.0 112.167 -178.326 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -78.86 145.64 34.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.15 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.48 HG22 HD11 ' A' ' 29' ' ' LEU . 31.3 pt -132.66 163.82 36.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.071 179.129 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 90.6 mttt -114.6 -176.74 2.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.232 0.539 . . . . 0.0 111.514 -179.545 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.48 ' HG2' ' HB2' ' A' ' 12' ' ' ASP . 63.6 mttt -63.37 -57.47 10.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.938 -179.494 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -100.02 -12.73 19.48 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.47 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 77.1 tt0 -51.83 143.15 13.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.886 0.374 . . . . 0.0 111.681 -178.989 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.547 ' C ' HD22 ' A' ' 29' ' ' LEU . 98.1 mtt180 -97.78 124.99 42.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.977 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.758 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.7 mm? -114.27 143.3 45.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.064 0.459 . . . . 0.0 111.695 -179.254 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.449 ' O ' HD22 ' A' ' 32' ' ' LEU . 4.0 m-90 -101.42 105.87 16.94 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.557 179.727 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.531 ' C ' HD22 ' A' ' 32' ' ' LEU . 79.3 mt -69.87 149.87 47.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.303 0.573 . . . . 0.0 111.936 -179.024 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.667 HD23 ' HA ' ' A' ' 41' ' ' VAL . 3.6 mm? -119.29 -31.88 4.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.797 -178.23 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -113.28 -83.74 0.6 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.114 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.514 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 18.2 m-20 72.01 3.84 4.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.899 -179.418 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.1 m -82.5 -36.04 26.82 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.886 0.374 . . . . 0.0 111.151 179.883 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -104.17 168.84 8.85 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.997 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 16.0 m -55.68 -30.31 60.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.673 178.494 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -97.56 126.97 43.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.854 178.253 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.514 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 42.5 m0 -106.88 134.22 50.35 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.582 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.483 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 58.4 ttp180 -92.24 127.21 37.63 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 177.475 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.758 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -135.1 161.73 39.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -178.293 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.458 ' HA ' HG22 ' A' ' 48' ' ' THR . 57.1 ttm-85 -123.25 139.9 53.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.713 -179.547 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.946 ' HB2' HD21 ' A' ' 21' ' ' LEU . 52.4 t30 -110.34 161.57 15.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.864 0.364 . . . . 0.0 111.274 179.878 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.25 -21.03 46.77 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.552 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.93 5.03 14.97 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.836 179.735 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 72.78 22.57 3.1 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.852 0.358 . . . . 0.0 111.001 -179.637 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.4 ' C ' HD13 ' A' ' 21' ' ' LEU . 99.7 mtt180 -107.23 132.44 53.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.158 179.242 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.458 HG22 ' HA ' ' A' ' 42' ' ' ARG . 73.2 p -127.27 151.0 49.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.696 0.284 . . . . 0.0 111.079 -179.592 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.497 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -170.5 172.84 44.27 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.577 -0.821 . . . . 0.0 113.115 -179.973 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.483 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 85.8 m-85 -101.52 114.04 27.7 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.641 0.258 . . . . 0.0 111.134 -179.905 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.518 HG13 ' HB3' ' A' ' 20' ' ' GLU . 15.7 m -136.05 114.15 10.77 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.737 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.24 43.21 0.84 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.164 1.909 . . . . 0.0 111.865 178.618 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.504 ' O ' HG12 ' A' ' 56' ' ' VAL . 88.6 p -71.07 90.3 0.85 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.001 0.429 . . . . 0.0 111.282 -179.383 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -66.21 -12.68 57.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.371 178.655 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.514 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.0 m-85 -62.63 -12.95 26.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.159 -179.995 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.585 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.2 p -115.35 141.18 33.3 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.099 0 CA-C-O 120.95 0.405 . . . . 0.0 110.695 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -137.94 164.73 28.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.331 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.722 ' HA ' HG12 ' A' ' 7' ' ' VAL . 17.1 mtp-105 -69.93 143.88 52.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.66 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.142 -0.932 . . . . 0.0 110.992 179.947 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.445 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.5 t . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 120.82 0.343 . . . . 0.0 110.708 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.7 mt -113.87 116.06 51.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.98 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.661 HG12 ' HB3' ' A' ' 58' ' ' ARG . 23.0 m -132.23 161.1 41.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.837 0.351 . . . . 0.0 111.568 179.923 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.964 HD12 ' HD2' ' A' ' 59' ' ' LYS . 15.5 mt -119.0 123.0 70.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.288 -179.668 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.676 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.62 123.58 25.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.631 -179.718 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.472 ' HE3' ' HE2' ' A' ' 59' ' ' LYS . 38.8 mttp -93.7 -10.63 33.74 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.081 -179.955 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.787 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 11.1 m-90 -140.74 145.11 35.99 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.944 0.402 . . . . 0.0 110.839 179.841 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -72.81 122.21 21.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.083 -179.281 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.463 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 57.5 t80 -127.55 139.77 52.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.101 179.99 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 91.1 m -103.02 138.96 39.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.675 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.62 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -61.88 139.23 58.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.519 -179.667 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -87.83 -1.23 57.84 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.464 179.23 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.498 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 93.1 mt-30 -145.99 169.71 18.08 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 178.791 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -75.13 -33.36 61.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.106 0.479 . . . . 0.0 110.945 -179.645 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -71.43 -16.32 62.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.925 -179.635 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.62 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -86.56 178.73 6.98 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.022 -179.649 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.46 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.1 mp -129.59 139.04 51.57 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-O 121.098 0.475 . . . . 0.0 111.859 -177.754 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -74.72 148.55 40.41 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.852 179.324 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.447 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 41.8 pt -129.29 164.0 32.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.911 179.221 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.445 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 96.9 mttt -118.99 163.64 16.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.141 0.496 . . . . 0.0 111.141 -179.858 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.485 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 10.8 pttm -63.87 -10.53 21.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.52 -0.764 . . . . 0.0 113.029 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -140.68 26.4 2.11 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.013 179.494 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.454 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 82.4 tt0 -102.03 143.11 32.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.046 0.45 . . . . 0.0 110.705 179.899 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.495 ' C ' HD22 ' A' ' 29' ' ' LEU . 82.6 mtm-85 -95.33 119.41 33.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.291 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.673 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -116.12 145.21 43.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.128 -179.661 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -100.92 107.53 19.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.492 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.445 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 63.6 mt -77.9 149.66 34.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.119 0.485 . . . . 0.0 111.538 -179.583 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.498 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.8 mp -114.55 -29.84 6.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.039 179.795 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -157.05 115.0 3.19 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.883 0.373 . . . . 0.0 110.601 179.772 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.495 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 35.7 p-10 -106.28 2.34 26.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.229 -179.49 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 87.6 p -67.67 -37.63 82.62 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.904 0.383 . . . . 0.0 111.904 -179.351 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -81.61 162.08 23.24 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.328 0.585 . . . . 0.0 112.38 -179.044 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.491 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 17.1 p -57.55 -39.74 77.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.856 177.838 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.508 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 54.3 m95 -96.97 130.21 44.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.47 -1.241 . . . . 0.0 108.745 177.791 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.495 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 38.2 m0 -102.62 132.97 48.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -177.862 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.485 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 51.9 ttt180 -87.45 132.07 34.12 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 177.794 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.673 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -138.9 157.12 28.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.926 0.393 . . . . 0.0 111.81 -178.724 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.435 ' CB ' HG22 ' A' ' 48' ' ' THR . 43.4 ttm180 -119.49 142.97 47.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.988 -179.664 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -113.08 163.16 15.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.391 -179.502 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.23 -20.68 43.73 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.463 179.769 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.603 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -77.79 5.79 8.8 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 179.679 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.1 m120 68.48 26.92 6.43 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 120.948 0.404 . . . . 0.0 111.307 -179.903 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.603 ' NH1' ' HB1' ' A' ' 45' ' ' ALA . 83.3 mtt85 -115.05 144.5 43.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.55 178.719 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.435 HG22 ' CB ' ' A' ' 42' ' ' ARG . 75.5 p -129.74 153.91 47.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.568 0.223 . . . . 0.0 110.715 -179.867 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -169.02 176.12 43.24 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.552 -179.728 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.485 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 94.7 m-85 -108.13 114.6 28.62 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.217 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.55 HG13 ' HB3' ' A' ' 20' ' ' GLU . 6.0 m -133.16 111.22 12.98 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.812 179.255 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.508 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 13.7 Cg_exo -70.18 41.16 0.34 Allowed 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.734 2.29 . . . . 0.0 112.502 178.487 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.598 ' O ' HG12 ' A' ' 56' ' ' VAL . 6.7 p -69.03 74.19 0.3 Allowed 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 120.676 0.274 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -54.13 -17.51 2.82 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.146 -0.346 . . . . 0.0 111.223 178.708 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.787 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 91.1 m-85 -61.43 -8.06 3.71 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 179.26 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.676 HG23 ' HA ' ' A' ' 9' ' ' ALA . 9.2 p -111.2 140.15 31.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 O-C-N 121.386 -0.821 . . . . 0.0 110.727 179.808 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -136.55 150.57 48.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.224 179.803 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.661 ' HB3' HG12 ' A' ' 7' ' ' VAL . 33.6 ptt-85 -72.0 147.26 47.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.315 -179.465 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.964 ' HD2' HD12 ' A' ' 8' ' ' ILE . 98.5 mttt . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.306 -0.854 . . . . 0.0 110.82 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 79.2 t . . . . . 0 C--O 1.226 -0.176 0 CA-C-O 120.365 0.126 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.5 mt -105.59 114.71 45.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.712 0.291 . . . . 0.0 111.751 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.722 HG12 ' HA ' ' A' ' 58' ' ' ARG . 30.8 m -132.98 159.46 43.17 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.741 0.305 . . . . 0.0 110.987 179.054 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.613 ' HB ' ' HD2' ' A' ' 59' ' ' LYS . 54.3 mt -121.5 124.28 71.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.062 0.458 . . . . 0.0 111.395 179.96 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.688 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.13 124.76 27.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.085 -179.989 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -93.08 -9.18 40.5 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.837 -179.992 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.813 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 14.3 m-90 -143.58 147.06 33.84 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.866 0.365 . . . . 0.0 110.473 179.431 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.3 p-10 -73.67 124.04 25.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.438 -178.719 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.46 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 46.3 t80 -128.64 135.09 48.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.511 179.173 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 66.8 m -100.36 139.88 35.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.267 0.556 . . . . 0.0 111.489 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.825 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.43 130.51 46.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.488 179.813 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -65.16 -28.21 69.25 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.015 0.436 . . . . 0.0 110.246 179.106 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -135.45 162.33 32.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.111 179.36 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -64.16 -29.91 71.0 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.904 0.383 . . . . 0.0 111.274 -179.705 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -69.48 -19.25 63.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.634 -179.757 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.825 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.3 mm-40 -82.55 -177.56 6.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.512 179.888 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.916 HD21 ' HB2' ' A' ' 43' ' ' ASN . 20.3 tp -123.7 133.14 53.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.138 0.494 . . . . 0.0 111.692 -178.913 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -77.65 148.56 34.97 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.806 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.472 HG22 ' HG ' ' A' ' 29' ' ' LEU . 36.6 pt -131.93 163.56 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.335 179.39 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 73.4 mmtt -118.38 164.2 15.6 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.144 0.497 . . . . 0.0 111.352 179.919 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.5 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 33.4 pttt -65.74 -11.11 42.91 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -179.671 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -140.6 23.34 2.3 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.168 179.638 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.472 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 78.6 tt0 -102.62 139.73 37.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.067 0.46 . . . . 0.0 110.695 179.939 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.58 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 11.9 ptp180 -95.25 121.38 36.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.212 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.658 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -113.58 152.69 29.96 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.517 -178.966 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.428 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 11.2 m-90 -103.36 105.57 15.87 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.501 -179.661 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.485 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 71.8 mt -77.63 146.34 36.19 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.076 0.465 . . . . 0.0 111.865 -179.335 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.569 HD13 ' HG2' ' A' ' 40' ' ' ARG . 4.9 mp -110.63 -29.53 7.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.203 179.976 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -158.96 116.74 2.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.865 0.364 . . . . 0.0 110.698 -179.672 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.485 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 42.6 p-10 -108.83 4.49 23.62 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.114 -179.381 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.7 m -68.32 -35.57 77.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.84 0.352 . . . . 0.0 111.383 -179.429 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -84.27 158.4 21.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.071 -179.162 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.476 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 19.3 p -55.36 -40.65 71.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.337 -0.847 . . . . 0.0 108.841 177.74 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.595 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 56.2 m95 -93.84 129.28 40.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.452 -1.249 . . . . 0.0 109.102 177.845 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.491 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 37.4 m0 -101.16 137.61 39.29 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.055 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.569 ' HG2' HD13 ' A' ' 32' ' ' LEU . 64.5 ttt180 -93.03 135.36 34.27 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 177.443 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.658 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -145.63 159.19 12.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.569 -178.935 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.633 ' HA ' HG22 ' A' ' 48' ' ' THR . 78.1 ttt180 -124.02 144.08 50.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.154 179.999 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.916 ' HB2' HD21 ' A' ' 21' ' ' LEU . 54.7 t30 -113.43 163.35 14.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.308 179.855 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.42 -24.7 63.7 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.662 -179.974 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.28 5.72 8.03 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.691 179.059 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 71.92 20.55 4.41 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.314 0.245 . . . . 0.0 111.08 -179.813 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -105.89 125.16 50.66 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.597 179.644 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.633 HG22 ' HA ' ' A' ' 42' ' ' ARG . 76.9 p -121.13 149.86 42.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.126 -179.732 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.62 176.74 40.43 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.639 179.719 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.491 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 85.7 m-85 -107.64 110.85 22.83 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.878 0.339 . . . . 0.0 111.579 -179.87 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.654 HG13 ' HB3' ' A' ' 20' ' ' GLU . 12.1 m -134.08 117.05 13.55 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 111.493 0.183 . . . . 0.0 111.493 179.515 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.595 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 57.6 Cg_endo -71.75 53.47 1.87 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.319 2.013 . . . . 0.0 111.613 179.111 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.646 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.8 m -66.92 92.99 0.25 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.093 -179.513 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.3 m120 -77.26 -10.4 59.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.902 0.382 . . . . 0.0 110.186 178.055 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.813 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 86.1 m-85 -81.37 6.24 15.03 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.323 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.688 HG23 ' HA ' ' A' ' 9' ' ' ALA . 13.2 p -118.08 144.66 25.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 O-C-N 121.946 -0.472 . . . . 0.0 110.51 179.591 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -128.09 156.82 42.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.824 -179.674 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.722 ' HA ' HG12 ' A' ' 7' ' ' VAL . 17.1 mtp-105 -73.43 142.44 46.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.793 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.613 ' HD2' ' HB ' ' A' ' 8' ' ' ILE . 56.3 mttm . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.876 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.428 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 58.6 t . . . . . 0 N--CA 1.455 -0.209 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.44 HG12 ' CD1' ' A' ' 30' ' ' TRP . 50.3 mt -111.28 117.39 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.008 179.8 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.794 HG12 ' CA ' ' A' ' 58' ' ' ARG . 32.9 m -131.18 160.79 42.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.071 179.646 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.581 ' C ' HG23 ' A' ' 56' ' ' VAL . 16.8 mt -119.84 122.17 67.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.822 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.496 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -77.01 124.33 27.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.265 -179.925 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.456 ' CE ' ' HE2' ' A' ' 59' ' ' LYS . 94.8 mttt -92.97 -11.05 34.21 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.905 179.813 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.706 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 9.2 m-90 -140.42 146.51 38.4 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.744 0.307 . . . . 0.0 110.553 -179.762 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -75.57 124.08 26.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.238 0.542 . . . . 0.0 111.553 -178.371 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.493 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 59.0 t80 -128.05 136.48 51.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.623 179.683 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 59.6 m -103.82 139.99 38.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.815 179.777 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.581 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -58.06 137.09 57.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.891 -179.937 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -86.72 -3.77 59.09 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.234 178.486 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.452 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 81.5 mm-40 -143.07 162.64 34.97 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.857 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -71.93 -19.67 61.87 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.706 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -89.21 -10.67 46.16 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -179.506 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.581 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.1 mt-10 -83.33 179.54 7.66 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.036 0.446 . . . . 0.0 110.247 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.797 HD21 ' HB2' ' A' ' 43' ' ' ASN . 15.9 tp -122.84 128.49 50.45 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.914 -178.394 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -71.76 147.62 47.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.41 179.729 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.493 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 40.1 pt -132.23 161.87 40.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.761 179.461 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 99.0 mttt -117.67 163.09 16.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.073 0.464 . . . . 0.0 111.226 -179.87 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.472 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 55.4 pttt -64.18 -12.17 37.79 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -179.667 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -138.84 22.94 2.65 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.942 179.355 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.479 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 51.6 tp10 -100.12 140.93 33.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.105 0.478 . . . . 0.0 111.219 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.441 ' C ' HD22 ' A' ' 29' ' ' LEU . 61.2 mtt85 -91.94 122.43 34.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.704 -179.852 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.694 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.4 mm? -115.29 145.31 42.6 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.612 -178.386 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.44 ' CD1' HG12 ' A' ' 6' ' ' ILE . 6.3 m0 -101.65 107.63 18.94 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.547 179.648 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.437 ' HA ' HG23 ' A' ' 41' ' ' VAL . 92.9 mt -79.18 148.83 32.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.342 0.591 . . . . 0.0 112.146 -179.205 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.9 mp -112.06 -28.96 7.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.486 179.181 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -161.05 118.08 2.31 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.264 179.496 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.504 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.6 p-10 -113.22 11.76 18.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.111 -179.472 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.2 p -71.21 -37.87 72.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.913 0.387 . . . . 0.0 111.288 -179.678 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.07 160.95 20.84 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.411 0.624 . . . . 0.0 112.344 -179.269 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 36.5 p -55.3 -40.37 71.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.061 178.002 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.553 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 50.7 m95 -92.39 132.67 36.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.819 177.812 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.504 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -106.84 138.67 42.58 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.054 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.482 ' HG2' HD13 ' A' ' 32' ' ' LEU . 56.2 ttt180 -96.1 129.08 43.48 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.161 177.867 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.694 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.4 p -141.74 159.23 21.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -177.987 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.45 ' CB ' HG22 ' A' ' 48' ' ' THR . 71.3 ttt180 -124.07 141.87 51.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.289 -179.627 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.797 ' HB2' HD21 ' A' ' 21' ' ' LEU . 48.7 t30 -110.12 162.69 14.32 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 120.985 0.422 . . . . 0.0 111.021 179.281 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.01 -19.32 51.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.922 178.608 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.56 5.59 8.79 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.027 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 66.56 26.96 9.76 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.165 0.507 . . . . 0.0 111.105 -179.455 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.458 ' O ' HD13 ' A' ' 21' ' ' LEU . 57.3 ttm-85 -113.79 125.32 53.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.822 178.957 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.45 HG22 ' CB ' ' A' ' 42' ' ' ARG . 77.6 p -118.51 143.59 46.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.936 0.398 . . . . 0.0 111.554 -179.221 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.562 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -161.06 172.01 37.23 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.75 179.961 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.478 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 95.7 m-85 -104.71 107.87 19.04 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 117.019 0.409 . . . . 0.0 111.995 -179.432 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.517 HG11 ' O ' ' A' ' 21' ' ' LEU . 11.4 m -122.75 120.12 27.85 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.305 178.744 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.553 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 61.7 Cg_endo -73.54 31.59 0.32 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.39 2.06 . . . . 0.0 112.542 178.484 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 86.4 p -61.72 93.95 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 120.997 0.427 . . . . 0.0 111.178 -179.641 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -78.6 -4.85 50.93 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.593 178.321 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.706 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 86.1 m-85 -72.18 -9.77 58.89 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.405 179.22 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.581 HG23 ' C ' ' A' ' 8' ' ' ILE . 6.9 p -120.2 139.71 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 121.187 0.518 . . . . 0.0 110.614 -179.819 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -144.1 160.21 41.29 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.072 179.88 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.794 ' CA ' HG12 ' A' ' 7' ' ' VAL . 77.9 ttt-85 -69.4 138.57 53.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.928 0.394 . . . . 0.0 110.919 -179.688 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.55 ' HD2' HD12 ' A' ' 8' ' ' ILE . 95.2 mttt . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.839 -179.901 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.479 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.0 t . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.43 HG23 ' CD1' ' A' ' 30' ' ' TRP . 8.4 mt -109.88 117.02 53.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.388 -179.743 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.712 HG12 ' CA ' ' A' ' 58' ' ' ARG . 33.1 m -131.94 160.35 42.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.831 0.348 . . . . 0.0 111.157 179.466 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.678 HG23 ' HG2' ' A' ' 28' ' ' ARG . 21.4 mt -117.63 126.66 74.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.844 179.735 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.545 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.79 149.68 39.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.147 0.498 . . . . 0.0 110.867 -179.885 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -112.02 -21.43 11.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.948 179.87 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.503 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 20.3 m-90 -139.26 151.3 46.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.838 179.991 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.509 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 57.1 t0 -74.59 125.45 28.67 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.07 0.462 . . . . 0.0 111.196 -178.761 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.488 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 61.2 t80 -128.08 137.5 52.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.942 179.813 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.8 t -103.49 139.28 39.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.651 179.784 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.841 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.19 129.81 43.41 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.42 -179.935 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.416 ' HG2' ' OH ' ' A' ' 13' ' ' TYR . 95.2 mm-40 -62.85 -33.46 75.3 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.308 0.575 . . . . 0.0 110.186 179.471 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -131.39 161.67 31.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.205 179.739 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -62.03 -33.9 75.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.084 0.469 . . . . 0.0 111.288 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -65.87 -20.16 66.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.202 179.888 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.841 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.8 mm-40 -83.32 179.24 7.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 0.0 110.979 -179.663 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.826 HD21 ' HB3' ' A' ' 43' ' ' ASN . 39.8 tp -121.7 126.06 48.09 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.893 -178.547 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -73.18 159.07 34.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.804 179.314 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.488 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 41.5 pt -141.83 166.87 16.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.366 179.807 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.486 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 57.1 mttm -114.48 178.67 4.2 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.215 0.531 . . . . 0.0 111.524 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.509 ' HG2' ' HB2' ' A' ' 12' ' ' ASP . 20.6 mttp -61.49 -52.31 65.03 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.234 -179.543 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -107.13 -1.36 22.04 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -178.097 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.486 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 79.5 tt0 -62.89 144.43 56.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.233 0.539 . . . . 0.0 111.205 -179.541 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.678 ' HG2' HG23 ' A' ' 8' ' ' ILE . 75.5 mtp180 -100.36 120.82 40.53 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.313 -179.984 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.684 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.2 mm? -111.65 149.37 31.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.549 -178.758 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.462 ' C ' HG23 ' A' ' 41' ' ' VAL . 5.2 m-90 -103.91 107.73 18.75 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.126 179.709 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.479 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 88.0 mt -76.23 147.68 38.18 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.031 0.443 . . . . 0.0 111.996 -179.172 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.2 mp -109.8 -28.93 8.54 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.596 179.482 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -160.97 117.71 2.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.69 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.522 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.5 p-10 -110.53 3.04 19.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.132 -179.558 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.6 m -63.96 -38.4 90.93 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.772 0.32 . . . . 0.0 111.61 -179.735 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.69 162.76 19.57 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.331 0.586 . . . . 0.0 112.506 -179.075 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.456 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 19.6 p -58.94 -37.23 76.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.244 178.291 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.635 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 68.6 m95 -94.77 131.05 41.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.579 -1.191 . . . . 0.0 108.525 177.959 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.522 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -105.44 137.08 43.84 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.99 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.492 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 69.2 ttt180 -94.61 129.9 41.27 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.048 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.778 HG13 HD23 ' A' ' 21' ' ' LEU . 2.4 p -143.29 155.1 16.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 C-N-CA 120.382 -0.527 . . . . 0.0 112.155 -178.384 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.707 ' HG3' HG22 ' A' ' 48' ' ' THR . 28.4 ttp-105 -123.74 142.2 51.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.912 -179.613 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.826 ' HB3' HD21 ' A' ' 21' ' ' LEU . 43.6 p-10 -111.65 171.66 7.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.676 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.5 -26.72 68.69 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.381 -179.978 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.468 ' HB3' HD21 ' A' ' 43' ' ' ASN . . . -71.37 5.4 2.3 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 179.451 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 66.57 25.14 10.08 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.092 0.472 . . . . 0.0 111.026 -179.404 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -110.32 127.8 55.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.598 178.945 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.707 HG22 ' HG3' ' A' ' 42' ' ' ARG . 11.8 p -121.79 145.63 47.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.724 0.297 . . . . 0.0 110.878 -179.344 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.484 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.92 170.46 39.99 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.996 179.73 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.492 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 90.6 m-85 -101.56 112.45 25.01 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -179.436 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.585 HG13 ' HB3' ' A' ' 20' ' ' GLU . 15.8 m -135.22 116.09 12.05 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.59 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.635 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 63.2 Cg_endo -73.09 45.44 0.95 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.384 2.056 . . . . 0.0 111.903 179.044 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.536 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.6 p -70.21 85.22 0.56 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.792 -179.663 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -63.9 -14.6 54.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.008 0.432 . . . . 0.0 110.443 178.724 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.503 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 94.4 m-85 -61.32 -14.6 28.24 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.624 179.367 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.66 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.3 p -118.23 140.03 43.19 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 CA-C-O 121.182 0.515 . . . . 0.0 111.201 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -145.5 159.13 43.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.381 179.676 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.712 ' CA ' HG12 ' A' ' 7' ' ' VAL . 80.5 ttt180 -71.0 135.2 47.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.839 0.352 . . . . 0.0 110.842 179.912 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.054 179.656 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.7 mmm . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.838 0.351 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 67.4 p -78.37 148.31 33.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.08 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -97.98 139.28 34.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.091 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -97.18 137.74 35.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.174 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.449 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 79.9 t -112.09 129.93 66.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.377 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 30.3 mm -98.49 114.58 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.16 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.466 HG21 HD11 ' A' ' 31' ' ' LEU . 22.4 m -132.25 165.66 31.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.969 0.414 . . . . 0.0 111.259 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.645 HG23 ' HG2' ' A' ' 28' ' ' ARG . 10.4 mt -128.84 129.02 68.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.51 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.702 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.93 141.14 45.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.605 -178.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -105.11 -20.18 13.6 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.746 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.585 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 18.4 m-90 -140.98 150.67 43.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.973 0.416 . . . . 0.0 110.027 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.8 p-10 -69.56 129.72 40.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.216 0.531 . . . . 0.0 112.072 -178.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.411 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 76.6 t80 -127.9 140.58 51.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.772 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.9 t -105.85 138.47 41.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.599 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.539 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -58.91 138.32 57.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.38 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -86.09 -3.26 58.91 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.364 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -146.17 170.15 17.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.708 0.29 . . . . 0.0 110.283 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -74.02 -27.29 60.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.497 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -80.56 -9.71 59.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.611 ' C ' HD12 ' A' ' 21' ' ' LEU . 0.5 OUTLIER -93.26 171.98 8.58 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.758 -179.889 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.611 HD12 ' C ' ' A' ' 20' ' ' GLU . 8.0 mp -120.19 134.88 55.15 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -74.62 147.0 42.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.424 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.698 HG22 HD11 ' A' ' 29' ' ' LEU . 46.0 pt -127.73 169.4 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.022 179.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -117.34 -176.74 3.07 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.158 0.504 . . . . 0.0 111.85 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -65.85 -37.55 86.5 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.786 -178.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -126.78 39.06 4.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.873 0.368 . . . . 0.0 111.409 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -100.37 132.41 45.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.645 ' HG2' HG23 ' A' ' 8' ' ' ILE . 50.9 mtm105 -88.08 125.7 34.71 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.451 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.698 HD11 HG22 ' A' ' 23' ' ' ILE . 1.1 mm? -116.07 150.31 37.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.824 -178.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 31.1 m-90 -102.62 105.82 16.38 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.442 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.611 HD23 HG23 ' A' ' 41' ' ' VAL . 88.4 mt -79.62 142.55 35.51 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.927 0.394 . . . . 0.0 112.028 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 41' ' ' VAL . 3.9 mp -111.3 -29.11 7.95 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.186 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -158.57 117.6 3.07 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.861 0.363 . . . . 0.0 111.251 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.44 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.4 p-10 -110.56 4.84 20.68 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.2 m -67.79 -36.22 80.05 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.815 0.341 . . . . 0.0 111.326 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -83.54 158.61 21.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.667 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 89.6 m -56.35 -35.22 67.38 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.332 178.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.9 m0 -99.15 133.05 43.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.44 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 42.2 m0 -104.39 134.68 47.19 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.422 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 53.4 ttt180 -86.62 133.08 33.73 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 178.046 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.632 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -137.78 161.49 33.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.02 0.438 . . . . 0.0 111.91 -177.929 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.429 ' CB ' HG22 ' A' ' 48' ' ' THR . 79.8 ttt180 -124.24 149.7 46.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.621 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.408 ' ND2' HD13 ' A' ' 29' ' ' LEU . 1.1 m120 -121.81 160.72 24.05 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.08 0.466 . . . . 0.0 111.488 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.97 -19.83 13.98 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.6 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.99 5.35 11.91 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 72.56 22.74 3.23 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 122.527 0.331 . . . . 0.0 111.452 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.401 ' C ' HD21 ' A' ' 21' ' ' LEU . 95.5 mtt-85 -108.19 146.43 32.78 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.429 HG22 ' CB ' ' A' ' 42' ' ' ARG . 75.6 p -134.95 147.78 49.86 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.846 179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.26 174.72 43.7 Favored Glycine 0 C--N 1.339 0.733 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.29 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 89.4 m-85 -102.59 108.31 19.54 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.544 HG11 ' O ' ' A' ' 21' ' ' LEU . 22.3 m -127.32 115.87 21.52 Favored Pre-proline 0 CA--C 1.533 0.314 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.1 63.65 4.19 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 121.564 1.51 . . . . 0.0 110.968 178.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.713 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.0 OUTLIER -72.98 76.72 1.18 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.516 -178.825 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -60.45 -19.17 55.52 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.208 177.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.585 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 71.5 m-85 -86.91 44.21 1.15 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.004 -0.544 . . . . 0.0 112.122 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 53' ' ' SER . 11.9 p -136.36 146.77 28.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.838 0.352 . . . . 0.0 111.001 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -122.82 140.12 53.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.312 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -75.25 139.97 42.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.854 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.404 ' CE ' ' HB ' ' A' ' 8' ' ' ILE . 51.4 mtmt . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.855 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ptp . . . . . 0 N--CA 1.501 2.119 0 CA-C-O 120.99 0.424 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.4 p -74.51 150.42 39.82 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.238 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -99.83 125.8 45.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.021 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -84.96 143.96 28.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.024 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.7 t -108.02 128.58 63.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.709 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.1 mt -107.32 115.52 48.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.197 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.797 HG12 ' HA ' ' A' ' 58' ' ' ARG . 21.5 m -128.83 161.09 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 111.411 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.579 ' C ' HG23 ' A' ' 56' ' ' VAL . 16.2 mt -119.83 128.72 75.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.12 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.407 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -84.71 117.46 23.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.004 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -90.92 -3.71 57.1 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.515 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 15.9 m-90 -147.08 141.65 26.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.785 0.326 . . . . 0.0 110.377 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.2 p-10 -71.31 120.0 16.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.847 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.414 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 60.9 t80 -127.62 137.11 52.45 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.57 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.6 m -99.93 141.97 32.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.748 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.809 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.48 131.98 51.77 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.792 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -63.72 -30.94 71.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.118 0.485 . . . . 0.0 110.184 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -137.69 160.89 37.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.256 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -59.54 -35.07 73.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.935 0.398 . . . . 0.0 111.169 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -65.19 -20.11 66.29 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.282 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.809 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 3.0 mm-40 -83.79 -179.35 7.27 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.59 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.84 HD23 HG13 ' A' ' 41' ' ' VAL . 24.1 tp -120.57 140.53 51.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.028 0.442 . . . . 0.0 112.085 -178.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -84.2 146.45 27.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.65 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.564 HG22 ' HG ' ' A' ' 29' ' ' LEU . 45.3 pt -131.36 160.99 41.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.192 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -116.71 167.24 11.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.073 0.464 . . . . 0.0 111.386 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 52.1 pttt -67.21 -14.86 63.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.79 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -140.0 22.21 2.44 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.671 -0.411 . . . . 0.0 111.561 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.416 ' HG3' ' CD2' ' A' ' 29' ' ' LEU . 40.4 tp10 -99.67 135.42 41.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.899 0.38 . . . . 0.0 110.516 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.527 ' HG2' HG23 ' A' ' 8' ' ' ILE . 69.2 mtp180 -90.53 120.77 31.9 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.754 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.564 ' HG ' HG22 ' A' ' 23' ' ' ILE . 0.3 OUTLIER -115.69 148.0 40.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.577 -179.601 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -101.62 109.77 21.63 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.079 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.456 ' HA ' HG23 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -81.02 152.63 27.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.383 0.611 . . . . 0.0 112.255 -179.05 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.5 mp -110.93 -25.4 9.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.07 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -160.99 117.41 2.26 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.745 0.307 . . . . 0.0 111.067 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.416 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.5 p-10 -110.8 7.18 21.89 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 86.0 p -74.1 -36.57 64.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.82 0.343 . . . . 0.0 111.371 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -81.1 161.41 24.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.371 0.605 . . . . 0.0 112.31 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.454 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 17.6 p -57.55 -40.5 79.02 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.007 178.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.471 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 43.8 m95 -93.94 131.17 39.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.918 177.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.422 ' HB3' HD21 ' A' ' 31' ' ' LEU . 32.0 m0 -102.67 129.68 49.34 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.433 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 44.3 ttt180 -91.78 127.17 37.13 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.595 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.84 HG13 HD23 ' A' ' 21' ' ' LEU . 3.2 p -140.16 161.97 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -177.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.526 ' HA ' HG22 ' A' ' 48' ' ' THR . 59.9 ttt85 -126.23 145.51 50.37 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.723 0.297 . . . . 0.0 111.202 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.469 ' HB2' HD21 ' A' ' 21' ' ' LEU . 61.8 t30 -113.19 161.54 17.04 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.917 0.389 . . . . 0.0 111.824 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.98 -21.05 58.01 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.262 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.65 6.35 15.45 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 68.05 26.07 7.37 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.949 0.404 . . . . 0.0 111.26 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.527 ' O ' HD13 ' A' ' 21' ' ' LEU . 75.0 ttt180 -110.23 123.44 49.78 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.448 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.526 HG22 ' HA ' ' A' ' 42' ' ' ARG . 52.5 p -121.74 156.94 32.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.749 0.309 . . . . 0.0 111.208 -179.113 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.451 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -173.48 171.03 44.18 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.365 -0.922 . . . . 0.0 113.308 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.429 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 90.4 m-85 -103.54 112.53 25.49 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.747 0.308 . . . . 0.0 111.28 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.559 HG13 ' HB3' ' A' ' 20' ' ' GLU . 2.9 m -132.29 114.74 14.85 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.03 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.471 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 8.7 Cg_exo -73.63 36.99 0.4 Allowed 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.721 2.281 . . . . 0.0 113.026 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.466 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -67.69 92.98 0.35 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 120.865 0.364 . . . . 0.0 111.267 -179.584 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -62.17 -17.55 58.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.281 178.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.515 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.0 m-85 -59.93 -14.82 17.48 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.579 HG23 ' C ' ' A' ' 8' ' ' ILE . 8.1 p -112.72 140.44 32.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.083 0.468 . . . . 0.0 110.835 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -136.82 165.24 26.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.064 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.797 ' HA ' HG12 ' A' ' 7' ' ' VAL . 92.0 mtt180 -69.55 139.43 53.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.915 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.7 pttp . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.738 179.977 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.7 mtm . . . . . 0 N--CA 1.501 2.096 0 CA-C-O 120.905 0.383 . . . . 0.0 111.666 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.415 HG22 ' H ' ' A' ' 4' ' ' GLU . 90.8 m -82.13 131.23 35.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.864 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -61.75 -35.81 79.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.02 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.415 ' H ' HG22 ' A' ' 2' ' ' THR . 98.4 mt-10 -69.67 139.12 53.46 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.936 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.478 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.1 t -110.35 130.02 64.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.627 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.8 mt -111.67 118.32 57.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.673 0.273 . . . . 0.0 111.709 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.6 HG12 ' HA ' ' A' ' 58' ' ' ARG . 21.4 m -134.11 160.67 41.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.034 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.467 ' HA ' ' HA ' ' A' ' 28' ' ' ARG . 33.6 mt -121.07 124.05 71.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.312 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.76 125.2 28.61 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.932 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.1 mttm -90.99 -9.24 46.72 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.58 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 12.5 m-90 -146.64 145.98 30.24 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.867 0.365 . . . . 0.0 110.876 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -69.91 125.23 26.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.995 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.455 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 65.6 t80 -127.81 141.16 51.65 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.502 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -104.19 136.66 43.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.922 0.392 . . . . 0.0 110.897 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.699 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.26 133.04 54.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.384 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -65.77 -34.27 77.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.187 0.518 . . . . 0.0 110.182 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -131.83 163.94 27.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.329 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -63.52 -31.15 72.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.864 0.364 . . . . 0.0 111.335 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -63.38 -27.25 69.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.301 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.699 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -82.6 -179.19 7.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.27 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.518 HD21 ' O ' ' A' ' 47' ' ' ARG . 6.4 mp -124.73 143.89 50.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.007 0.432 . . . . 0.0 111.345 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -81.44 148.78 29.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.407 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.455 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 49.8 pt -130.96 162.89 38.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.262 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -116.29 171.51 7.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.811 0.339 . . . . 0.0 110.873 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.459 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 16.1 ptpt -69.45 -10.99 60.42 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.7 p-10 -138.46 25.32 2.65 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.714 -0.395 . . . . 0.0 111.366 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.413 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 78.6 tt0 -101.08 139.16 37.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.783 0.325 . . . . 0.0 111.162 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.555 ' C ' HD22 ' A' ' 29' ' ' LEU . 35.8 ptt180 -99.01 121.25 40.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.95 0.405 . . . . 0.0 111.305 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.555 HD22 ' C ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -115.28 153.98 29.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.555 -179.564 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -101.96 112.31 24.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.687 0.28 . . . . 0.0 111.517 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.478 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 40.2 mt -78.19 145.03 35.82 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.928 0.394 . . . . 0.0 111.455 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.8 mp -111.27 -27.09 8.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.324 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -157.52 115.93 3.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.853 0.359 . . . . 0.0 111.038 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.458 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -107.14 4.14 26.5 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.3 t -68.94 -36.66 78.22 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.865 0.364 . . . . 0.0 111.441 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -81.83 159.18 23.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.859 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 86.1 m -59.82 -35.66 75.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.194 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.527 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 8.8 m0 -99.99 125.2 45.99 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.458 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 42.5 m0 -94.96 138.44 32.69 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.429 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 66.6 ttt180 -91.83 137.54 32.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.555 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -140.4 161.44 24.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.619 -0.433 . . . . 0.0 112.134 -178.146 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.484 ' HB2' HG22 ' A' ' 48' ' ' THR . 46.1 ttp180 -123.48 143.88 49.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.784 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -111.2 162.88 14.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.431 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.9 -19.89 20.23 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.739 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.25 6.0 15.43 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 69.96 24.77 5.05 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-O 120.786 0.327 . . . . 0.0 110.983 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.518 ' O ' HD21 ' A' ' 21' ' ' LEU . 62.7 ttt180 -111.09 128.77 55.99 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.048 179.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.484 HG22 ' HB2' ' A' ' 42' ' ' ARG . 72.8 p -116.91 156.82 26.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.926 0.393 . . . . 0.0 111.16 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.59 178.4 43.91 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.038 -0.601 . . . . 0.0 112.087 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.429 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 97.1 m-85 -106.86 112.31 25.22 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.924 0.392 . . . . 0.0 111.109 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.503 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.7 t -124.54 112.16 27.7 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.658 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.527 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 7.5 Cg_exo -72.9 36.6 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.514 2.143 . . . . 0.0 112.759 178.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' HG12 ' A' ' 56' ' ' VAL . 61.9 p -65.06 97.72 0.26 Allowed 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 120.599 0.238 . . . . 0.0 110.899 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -80.73 -3.68 51.7 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.078 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.58 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 81.1 m-85 -76.74 -1.61 28.88 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 53' ' ' SER . 7.3 p -111.66 142.03 25.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 121.076 0.465 . . . . 0.0 110.859 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -125.86 145.4 50.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.028 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.6 ' HA ' HG12 ' A' ' 7' ' ' VAL . 64.6 mtp180 -69.3 135.69 50.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.962 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.438 ' HD2' HD12 ' A' ' 8' ' ' ILE . 53.2 mttp . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.865 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttm . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.888 0.375 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 68.8 p -75.32 149.11 38.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.984 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -102.12 131.29 48.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.123 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -75.25 139.28 42.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.506 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.6 t -116.99 129.38 73.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.362 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.3 mt -117.54 123.53 71.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.638 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.698 HG12 ' HA ' ' A' ' 58' ' ' ARG . 29.8 m -134.37 159.6 41.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.221 0.534 . . . . 0.0 112.053 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.779 HG23 ' HG2' ' A' ' 28' ' ' ARG . 24.2 mt -117.15 127.13 74.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.093 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.691 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.38 148.72 43.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.95 -179.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -113.85 -16.48 12.23 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.589 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.509 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 11.6 m-90 -145.21 148.39 33.48 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.913 0.387 . . . . 0.0 110.325 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -68.49 126.51 29.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.667 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.425 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 45.7 t80 -127.25 135.78 51.09 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.163 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.3 m -105.52 120.77 42.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.026 0.441 . . . . 0.0 110.081 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.514 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -52.92 143.46 16.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.048 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -129.51 40.45 3.59 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.185 0.517 . . . . 0.0 111.473 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.521 ' H ' ' HG2' ' A' ' 20' ' ' GLU . 29.6 mm100 -135.52 176.41 8.7 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.861 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -78.24 -38.68 42.41 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -122.95 77.69 1.48 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.218 0.532 . . . . 0.0 109.94 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.672 ' C ' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -138.95 -179.39 5.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.408 -177.715 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.802 HD11 ' HG2' ' A' ' 47' ' ' ARG . 8.9 mp -137.01 137.39 39.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.101 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.9 p-10 -80.18 150.07 30.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.995 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 46.4 pt -129.44 164.17 32.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 120.655 0.264 . . . . 0.0 110.7 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -112.91 -177.59 3.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.28 0.562 . . . . 0.0 111.451 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -61.44 -52.25 65.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.827 -178.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -105.91 -7.89 17.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.418 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 80.5 tt0 -54.67 146.21 17.3 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.789 0.328 . . . . 0.0 111.515 -179.489 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.779 ' HG2' HG23 ' A' ' 8' ' ' ILE . 82.4 mtm180 -107.32 125.48 51.23 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.446 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.571 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -116.26 156.24 26.94 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.796 0.331 . . . . 0.0 110.738 179.737 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.466 ' O ' HD22 ' A' ' 32' ' ' LEU . 5.7 m-90 -104.68 106.61 17.18 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.647 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.546 ' HA ' HG23 ' A' ' 41' ' ' VAL . 25.9 mt -68.53 143.42 54.94 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.513 0.673 . . . . 0.0 112.13 -178.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.596 HD23 ' HA ' ' A' ' 41' ' ' VAL . 3.9 mm? -112.48 -35.86 5.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.631 -178.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -157.15 115.33 3.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.432 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.444 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 38.4 p-10 -111.99 4.31 18.04 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.3 m -67.47 -39.3 85.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.791 0.329 . . . . 0.0 111.606 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -81.27 159.59 24.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.782 -179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -35.24 68.61 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.473 ' CE3' ' HG3' ' A' ' 52' ' ' PRO . 16.8 m95 -96.22 131.18 42.97 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 177.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.472 ' CZ3' HD11 ' A' ' 31' ' ' LEU . 37.7 m0 -104.07 135.44 45.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.168 0.509 . . . . 0.0 112.313 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 49' ' ' GLY . 75.2 ttt180 -94.65 130.29 41.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.596 ' HA ' HD23 ' A' ' 32' ' ' LEU . 1.4 p -137.03 157.3 35.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.443 ' HB2' HD21 ' A' ' 32' ' ' LEU . 37.8 ttm180 -120.55 141.58 50.13 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.075 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -113.18 163.18 15.09 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.676 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.73 -18.94 5.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.17 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.43 6.43 10.24 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 66.05 26.1 10.81 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.052 0.453 . . . . 0.0 111.043 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.802 ' HG2' HD11 ' A' ' 21' ' ' LEU . 56.7 ttp180 -112.32 143.55 43.24 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.463 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.404 HG22 ' CB ' ' A' ' 42' ' ' ARG . 73.1 p -132.76 161.61 33.61 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.791 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.649 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -177.81 -176.34 45.74 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.966 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.438 ' O ' ' HB3' ' A' ' 20' ' ' GLU . 93.6 m-85 -110.69 115.19 29.14 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -178.062 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 51' ' ' VAL . 4.4 m -137.91 112.75 8.97 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.971 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.473 ' HG3' ' CE3' ' A' ' 38' ' ' TRP . 2.7 Cg_exo -74.77 56.35 4.09 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.145 1.897 . . . . 0.0 111.371 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.771 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -73.08 82.24 1.27 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.073 0.463 . . . . 0.0 111.707 -178.83 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -64.64 -14.78 59.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.638 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.509 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.6 m-85 -71.1 -7.17 44.72 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 53' ' ' SER . 9.3 p -110.03 146.58 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.94 0.4 . . . . 0.0 110.888 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -136.59 162.43 33.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.506 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.698 ' HA ' HG12 ' A' ' 7' ' ' VAL . 77.5 mtp180 -69.39 140.89 54.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.771 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.979 179.853 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.3 mtm . . . . . 0 N--CA 1.498 1.95 0 CA-C-O 120.843 0.354 . . . . 0.0 111.754 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 65.1 m -80.0 137.95 36.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.922 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.75 134.33 35.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.999 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -100.32 138.39 37.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.418 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.495 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 57.9 t -115.34 133.7 60.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.251 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.1 mt -103.11 119.25 51.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.665 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.665 HG12 ' HA ' ' A' ' 58' ' ' ARG . 35.1 m -132.29 160.24 42.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.564 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.687 ' C ' HG23 ' A' ' 56' ' ' VAL . 26.0 mm -118.48 123.96 72.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.922 0.392 . . . . 0.0 111.329 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.527 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -76.38 120.52 21.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.514 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -93.01 -6.74 47.64 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.594 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 6.8 m-90 -143.99 143.78 31.37 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.796 0.331 . . . . 0.0 110.399 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -71.38 121.66 18.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.048 0.451 . . . . 0.0 111.722 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.433 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 54.2 t80 -127.18 135.52 50.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.692 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.4 m -102.73 141.73 35.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.016 0.436 . . . . 0.0 110.93 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.631 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.76 135.17 51.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.675 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -84.97 -4.87 59.31 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.697 0.284 . . . . 0.0 110.959 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.438 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 74.9 mt-30 -143.9 171.73 13.83 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -76.37 -28.79 56.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.894 0.378 . . . . 0.0 111.775 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -81.36 -6.7 59.19 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.631 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.1 mt-10 -86.04 179.09 7.04 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.736 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.857 HD23 HG13 ' A' ' 41' ' ' VAL . 28.8 tp -124.27 126.57 46.29 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.997 0.427 . . . . 0.0 111.672 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -68.95 149.51 48.76 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.027 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.597 HG22 ' HG ' ' A' ' 29' ' ' LEU . 46.4 pt -134.88 165.24 31.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.249 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -118.88 166.97 12.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.055 0.455 . . . . 0.0 111.353 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.414 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 55.4 pttt -67.22 -12.56 60.38 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -139.73 21.4 2.5 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.364 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -97.88 141.15 31.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.901 0.381 . . . . 0.0 110.636 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.567 ' HB3' HD12 ' A' ' 8' ' ' ILE . 35.9 ptt-85 -98.72 120.63 39.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.571 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.67 HD22 ' N ' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -113.75 148.17 36.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.032 0.444 . . . . 0.0 111.693 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 15.8 m-90 -99.83 111.31 23.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.979 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.495 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 62.4 mt -72.95 147.32 45.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.809 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.777 HD13 ' HG2' ' A' ' 40' ' ' ARG . 5.2 mp -109.51 -30.89 7.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.415 -179.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -133.72 -66.37 0.64 Allowed 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 120.809 0.338 . . . . 0.0 111.483 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.466 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 3.2 p30 51.6 16.41 0.45 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.621 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.6 m -77.93 -35.87 50.01 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.912 0.387 . . . . 0.0 110.89 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.4 mmtt -92.34 175.3 6.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.646 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.9 m -59.15 -27.86 66.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.723 178.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.489 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 49.4 m95 -99.75 127.64 45.88 Favored 'General case' 0 CA--C 1.522 -0.114 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 177.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.466 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 38.4 m0 -108.23 128.51 54.78 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -176.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.777 ' HG2' HD13 ' A' ' 32' ' ' LEU . 23.5 ttm180 -87.84 135.94 33.17 Favored 'General case' 0 C--O 1.231 0.087 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 177.44 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.857 HG13 HD23 ' A' ' 21' ' ' LEU . 1.4 p -145.36 161.9 12.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.221 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HA ' HG22 ' A' ' 48' ' ' THR . 65.5 ttt180 -120.84 144.06 48.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.009 0.433 . . . . 0.0 111.606 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.855 ' HB2' HD21 ' A' ' 21' ' ' LEU . 55.9 t30 -114.33 161.12 18.31 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.319 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.38 -20.39 29.25 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.816 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.85 6.4 13.24 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 67.69 26.02 7.99 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.062 0.458 . . . . 0.0 111.121 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.633 ' O ' HD13 ' A' ' 21' ' ' LEU . 85.6 mtt-85 -111.72 128.54 56.12 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.647 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.444 HG22 ' HA ' ' A' ' 42' ' ' ARG . 30.5 p -125.61 151.4 46.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.336 -179.201 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.551 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -172.47 172.64 45.04 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.685 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.467 ' CE1' ' HB2' ' A' ' 40' ' ' ARG . 52.6 m-85 -96.75 108.55 21.22 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.48 HG13 ' HB3' ' A' ' 20' ' ' GLU . 4.2 m -126.91 111.36 22.06 Favored Pre-proline 0 C--N 1.333 -0.116 0 CA-C-N 116.794 -0.185 . . . . 0.0 111.208 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.489 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 60.5 Cg_endo -72.23 46.46 0.93 Allowed 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 121.788 1.659 . . . . 0.0 111.733 178.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.68 ' O ' HG12 ' A' ' 56' ' ' VAL . 9.1 p -72.99 81.62 1.21 Allowed 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 120.973 0.416 . . . . 0.0 111.112 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 p30 -58.05 -19.45 31.67 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.113 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.594 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.6 m-85 -57.22 -16.92 9.36 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.724 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.687 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.2 p -108.98 140.57 27.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.045 0.45 . . . . 0.0 110.859 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -135.42 162.56 32.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.026 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.665 ' HA ' HG12 ' A' ' 7' ' ' VAL . 41.1 ttm180 -70.08 139.14 52.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.912 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.3 tttp . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.953 -179.929 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.0 mtm . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 120.79 0.329 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.0 t -97.38 137.69 35.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.468 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -94.38 138.0 32.86 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.869 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -99.26 139.01 35.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.288 0.566 . . . . 0.0 111.711 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.412 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 53.2 t -118.25 128.29 75.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.428 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.1 mt -109.81 119.79 59.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.249 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.628 HG12 ' CA ' ' A' ' 58' ' ' ARG . 34.1 m -134.03 161.11 41.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.85 0.357 . . . . 0.0 111.244 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.669 HD12 ' HG2' ' A' ' 28' ' ' ARG . 17.2 mm -115.89 121.95 68.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.034 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.573 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -76.12 126.77 31.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.722 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -99.67 -10.6 21.76 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.596 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.3 m-90 -141.96 145.26 34.3 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.839 0.352 . . . . 0.0 110.462 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -72.53 122.64 21.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.627 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.422 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 55.8 t80 -127.71 139.03 52.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.723 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.3 m -103.14 134.47 46.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.001 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.76 ' HB1' ' HG3' ' A' ' 20' ' ' GLU . . . -56.43 142.26 39.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.965 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -88.75 -4.56 58.49 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -149.45 176.95 10.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.637 0.256 . . . . 0.0 110.662 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -75.78 -34.18 60.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.127 0.489 . . . . 0.0 110.694 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -62.45 -35.98 81.0 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.146 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.894 ' HB2' HG13 ' A' ' 51' ' ' VAL . 0.9 OUTLIER -81.7 178.61 8.23 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.469 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.57 ' O ' HG11 ' A' ' 51' ' ' VAL . 10.2 mp -126.12 161.33 27.88 Favored 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 121.32 0.581 . . . . 0.0 112.093 -178.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -90.53 148.1 22.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.162 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.5 HG22 HD11 ' A' ' 29' ' ' LEU . 40.2 pt -130.06 163.21 36.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.441 ' HB3' ' HB2' ' A' ' 27' ' ' GLU . 86.4 tttt -117.72 164.54 14.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.991 0.424 . . . . 0.0 111.277 -178.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.439 ' N ' ' HG2' ' A' ' 24' ' ' LYS . 11.0 ptpp? -63.31 -12.89 33.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -137.75 5.55 2.64 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 24' ' ' LYS . 77.1 tt0 -77.27 146.79 36.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.753 0.311 . . . . 0.0 110.599 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.669 ' HG2' HD12 ' A' ' 8' ' ' ILE . 86.3 mtm180 -94.96 119.64 33.83 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 120.979 0.418 . . . . 0.0 110.875 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.608 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.6 mm? -113.77 142.41 46.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.468 -179.183 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -103.32 109.63 21.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.695 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.412 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 90.6 mt -79.68 151.12 30.67 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.312 0.577 . . . . 0.0 111.67 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -114.99 -29.01 6.82 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.804 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -161.4 118.36 2.23 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.363 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.456 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.1 p-10 -110.33 2.89 19.38 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.6 m -63.58 -38.9 92.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.955 0.407 . . . . 0.0 111.367 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -82.8 159.49 22.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.675 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.08 -35.6 71.62 Favored 'General case' 0 C--O 1.23 0.065 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.448 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 45.1 m95 -94.85 132.05 40.08 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.456 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 40.1 m0 -105.9 132.47 51.97 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -177.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -86.87 131.96 33.96 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.608 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.6 p -140.7 159.56 24.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -177.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.503 ' CB ' HG22 ' A' ' 48' ' ' THR . 44.2 ttm180 -123.79 141.78 51.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.568 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -110.38 162.26 14.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.588 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.36 -19.93 39.57 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.587 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.79 5.01 14.67 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.8 t30 71.88 26.4 2.96 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 110.886 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.443 ' HB2' HD21 ' A' ' 21' ' ' LEU . 99.5 mtt180 -112.47 133.98 54.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.127 179.435 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.503 HG22 ' CB ' ' A' ' 42' ' ' ARG . 73.5 p -124.58 148.1 48.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.901 0.381 . . . . 0.0 111.205 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.715 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -163.23 -178.67 37.17 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.628 -179.468 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 92.0 m-85 -113.27 97.05 6.24 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.894 HG13 ' HB2' ' A' ' 20' ' ' GLU . 0.2 OUTLIER -112.97 121.11 39.13 Favored Pre-proline 0 C--N 1.329 -0.315 0 C-N-CA 121.341 -0.144 . . . . 0.0 110.753 178.288 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.448 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 96.0 Cg_endo -78.26 43.33 1.39 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.018 1.812 . . . . 0.0 111.697 177.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.563 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -71.01 87.84 0.75 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.868 0.366 . . . . 0.0 111.343 -179.292 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -68.32 -11.63 59.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.524 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.596 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 98.7 m-85 -69.09 -10.47 57.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.573 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.3 p -114.86 141.49 31.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.996 0.427 . . . . 0.0 110.691 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -146.88 161.58 40.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.858 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.628 ' CA ' HG12 ' A' ' 7' ' ' VAL . 79.5 ttt-85 -69.84 138.84 52.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.881 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.527 ' HG2' ' HG2' ' A' ' 58' ' ' ARG . 74.6 mmtt . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.916 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.1 mtp . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 120.839 0.352 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 76.1 p -75.19 157.6 34.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.832 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -72.86 -27.77 62.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.025 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -103.98 128.39 51.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.831 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.421 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 55.2 t -107.86 132.28 55.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.472 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.0 mm -97.05 118.45 43.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.166 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.833 HG12 ' HA ' ' A' ' 58' ' ' ARG . 30.5 m -134.33 162.86 38.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.184 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.78 HD12 ' HG2' ' A' ' 28' ' ' ARG . 26.8 mm -120.96 130.38 74.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.035 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.18 150.92 38.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.844 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -117.09 -14.17 10.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.748 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.402 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 8.6 m-90 -148.69 149.98 32.4 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.93 0.395 . . . . 0.0 110.962 -179.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -74.18 121.92 21.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.14 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -127.4 137.43 52.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.997 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.3 m -99.76 137.32 38.4 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.287 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.653 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -51.19 129.57 24.64 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.927 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -62.4 -23.74 67.0 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.985 0.422 . . . . 0.0 110.449 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.455 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 96.1 mt-30 -139.47 172.91 12.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.071 179.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -72.8 -29.39 63.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.926 0.393 . . . . 0.0 111.482 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -72.12 -17.46 61.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.911 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.653 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -86.22 179.61 6.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.725 0.298 . . . . 0.0 110.327 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 43' ' ' ASN . 15.3 tp -118.9 143.57 46.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.22 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -86.0 151.66 23.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.654 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 33.7 pt -134.07 162.48 39.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.73 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -114.22 -176.95 3.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.195 0.522 . . . . 0.0 111.24 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 26.1 mttt -63.56 -52.95 58.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.427 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -109.1 -0.17 19.55 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -57.4 142.48 43.65 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.943 0.401 . . . . 0.0 111.404 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.78 ' HG2' HD12 ' A' ' 8' ' ' ILE . 92.5 mtt180 -94.7 122.29 37.16 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.343 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.641 ' HB3' HG21 ' A' ' 41' ' ' VAL . 3.8 mm? -111.38 145.43 38.9 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 26.6 m-90 -105.47 108.44 19.95 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.554 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.535 HD23 HG23 ' A' ' 41' ' ' VAL . 68.1 mt -72.16 147.42 46.63 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.071 0.463 . . . . 0.0 111.891 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.4 mp -112.6 -28.52 7.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.255 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -158.51 116.41 2.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.804 0.335 . . . . 0.0 111.101 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.445 ' OD2' HD13 ' A' ' 31' ' ' LEU . 96.4 m-20 -110.08 9.12 24.15 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.195 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 87.9 p -77.19 -35.13 56.06 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.923 0.392 . . . . 0.0 110.99 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -82.79 157.44 23.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.424 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -58.44 -36.78 74.18 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.428 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 15.2 m95 -95.51 130.17 42.44 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 177.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.422 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 32.3 m0 -100.91 134.41 43.94 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.16 0.505 . . . . 0.0 112.277 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.451 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 73.5 ttt180 -92.79 133.06 36.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 177.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.641 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.2 p -140.48 147.05 23.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.929 -177.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.406 ' CB ' ' HB ' ' A' ' 48' ' ' THR . 58.8 ttt180 -118.54 153.3 34.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.653 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.763 ' HB3' HD21 ' A' ' 21' ' ' LEU . 53.4 p-10 -122.49 171.8 8.83 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.033 0.444 . . . . 0.0 111.808 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.36 -15.08 46.34 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.174 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.88 6.08 10.01 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 66.32 23.18 10.76 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.885 0.374 . . . . 0.0 111.269 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.601 ' O ' HD13 ' A' ' 21' ' ' LEU . 66.9 mtt180 -119.53 129.41 54.67 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.406 ' HB ' ' CB ' ' A' ' 42' ' ' ARG . 5.7 t -135.99 155.85 49.63 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.684 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.528 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.81 -173.66 36.06 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 120.628 -0.796 . . . . 0.0 113.021 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.451 ' HA ' ' HA ' ' A' ' 40' ' ' ARG . 98.1 m-85 -99.66 107.62 19.78 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.69 HG21 ' O ' ' A' ' 21' ' ' LEU . 20.5 t -125.56 119.83 24.6 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.276 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.428 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 77.4 Cg_endo -83.21 39.63 0.84 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.217 1.945 . . . . 0.0 111.733 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.632 ' O ' HG12 ' A' ' 56' ' ' VAL . 25.6 p -68.5 90.05 0.37 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.877 0.37 . . . . 0.0 111.617 -179.075 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -65.94 -13.59 60.04 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.45 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -60.22 -14.4 17.49 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.632 HG12 ' O ' ' A' ' 53' ' ' SER . 7.7 p -111.08 147.16 15.29 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 120.847 0.356 . . . . 0.0 110.759 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -146.07 164.9 30.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.64 -179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.833 ' HA ' HG12 ' A' ' 7' ' ' VAL . 91.9 mtm-85 -68.4 141.86 55.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.332 . . . . 0.0 110.562 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.249 -0.881 . . . . 0.0 110.969 179.959 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.535 ' O ' HG22 ' A' ' 2' ' ' THR . 98.2 mtp . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.843 0.354 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 1' ' ' MET . 11.4 t 48.45 36.09 6.78 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.968 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -92.24 132.5 36.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 0.0 111.215 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -82.02 148.75 28.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.083 0.468 . . . . 0.0 111.0 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 68.5 t -115.05 130.25 69.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.698 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.434 HG23 ' CD1' ' A' ' 30' ' ' TRP . 25.4 mt -112.87 119.0 59.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.848 0.356 . . . . 0.0 111.403 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.618 HG12 ' HA ' ' A' ' 58' ' ' ARG . 34.2 m -132.68 161.65 41.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.07 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.64 ' C ' HG23 ' A' ' 56' ' ' VAL . 30.7 mt -117.43 129.38 74.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.957 0.408 . . . . 0.0 111.339 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.619 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.85 148.29 38.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.362 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -113.31 -17.81 12.21 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.693 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.472 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.9 m-90 -143.62 134.54 25.4 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.965 0.412 . . . . 0.0 111.014 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -60.04 125.32 23.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.626 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -127.54 141.32 51.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.982 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 86.8 m -106.38 138.35 42.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.404 179.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.618 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.92 132.27 49.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.728 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -66.79 -24.67 66.21 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.138 0.494 . . . . 0.0 110.58 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.409 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 96.3 mt-30 -136.12 170.67 15.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.103 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -72.46 -28.11 62.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.79 0.328 . . . . 0.0 111.168 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -69.96 -21.2 63.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.794 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.618 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -82.9 -179.24 7.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.839 0.352 . . . . 0.0 110.556 179.901 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.78 HD21 ' HB3' ' A' ' 43' ' ' ASN . 11.7 tp -118.1 139.92 50.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.323 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -83.54 140.67 32.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.422 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.416 HG22 HD11 ' A' ' 29' ' ' LEU . 32.3 pt -126.56 165.39 24.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.53 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.4 mttm -114.35 -178.68 3.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.12 0.486 . . . . 0.0 111.523 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -64.01 -52.14 60.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.396 -178.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -106.44 -6.42 18.21 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.78 146.75 30.36 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.918 0.39 . . . . 0.0 111.022 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.604 ' HG2' HG23 ' A' ' 8' ' ' ILE . 23.7 mtm105 -101.3 124.86 47.66 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.875 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.533 HD22 ' C ' ' A' ' 28' ' ' ARG . 1.3 mm? -114.32 149.78 35.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.157 0.503 . . . . 0.0 111.644 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.434 ' CD1' HG23 ' A' ' 6' ' ' ILE . 5.2 m-90 -102.17 115.73 31.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.419 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.709 ' C ' HD23 ' A' ' 32' ' ' LEU . 40.6 mt -79.88 146.22 32.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.367 0.603 . . . . 0.0 112.337 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.709 HD23 ' C ' ' A' ' 31' ' ' LEU . 1.7 mt -108.94 -35.0 6.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.308 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -159.61 117.59 2.73 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.11 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.442 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.8 p-10 -107.41 4.94 26.84 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.163 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.9 m -69.11 -36.56 77.67 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.776 0.322 . . . . 0.0 111.696 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -84.06 156.84 22.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.101 0.477 . . . . 0.0 112.035 -179.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 60.2 m -55.75 -31.29 62.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.368 177.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.2 m95 -101.59 134.25 45.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.442 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.5 m0 -103.82 138.01 41.02 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.154 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -97.13 130.45 44.39 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.526 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.5 OUTLIER -139.56 148.62 23.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 120.59 -0.444 . . . . 0.0 112.023 -177.73 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -122.99 146.53 47.54 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.886 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.78 ' HB3' HD21 ' A' ' 21' ' ' LEU . 52.3 p-10 -113.44 171.2 7.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.038 0.447 . . . . 0.0 112.022 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.22 -16.2 31.37 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.991 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.61 5.04 16.61 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 69.93 22.09 6.0 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.75 0.309 . . . . 0.0 111.143 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -116.46 128.62 55.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.11 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.5 t -134.04 151.46 51.43 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.318 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.445 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -160.77 -173.43 29.36 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.807 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -100.06 104.55 16.13 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 111.106 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.57 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.3 t -123.88 112.29 28.84 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.023 179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.8 44.34 1.27 Allowed 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 121.794 1.662 . . . . 0.0 111.437 177.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.648 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.9 p -72.92 81.97 1.2 Allowed 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 120.88 0.371 . . . . 0.0 111.467 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -64.76 -13.36 54.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.338 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.472 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.9 m-85 -62.94 -10.92 15.35 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 53' ' ' SER . 7.3 p -108.82 141.78 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-O 121.05 0.453 . . . . 0.0 111.033 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -130.17 158.46 39.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.651 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.618 ' HA ' HG12 ' A' ' 7' ' ' VAL . 24.3 ttm105 -70.22 129.65 39.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.925 0.393 . . . . 0.0 111.25 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.251 179.723 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.0 mtp . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.86 0.362 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.6 m -79.82 132.24 36.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.923 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -98.48 124.38 43.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.021 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -98.94 137.25 37.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.195 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.55 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 99.6 t -116.64 133.01 64.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.586 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mt -101.08 119.12 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.877 0.37 . . . . 0.0 111.235 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.626 HG12 ' HA ' ' A' ' 58' ' ' ARG . 34.9 m -131.96 163.03 38.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.545 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.647 HG23 ' HG2' ' A' ' 28' ' ' ARG . 47.3 mt -122.89 127.59 74.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.77 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.566 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.08 145.25 44.57 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.952 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -108.83 -18.01 13.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.887 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.533 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 9.7 m-90 -143.87 147.54 34.19 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.844 0.354 . . . . 0.0 111.595 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.495 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 60.5 t0 -69.89 123.14 20.73 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.179 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.425 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 65.1 t80 -128.52 134.88 48.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.666 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 92.6 m -99.5 140.97 32.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.413 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.674 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -53.37 131.49 37.87 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.599 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -67.41 -18.32 65.07 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.384 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.46 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 93.0 mt-30 -142.6 173.7 11.3 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -76.24 -22.27 55.36 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.678 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -82.11 -7.04 59.6 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.674 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.1 mt-10 -92.88 -179.96 5.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.92 0.39 . . . . 0.0 110.744 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.969 HD23 HG13 ' A' ' 41' ' ' VAL . 46.3 tp -116.59 140.51 49.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.554 -178.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -85.62 150.06 24.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.837 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 31.2 pt -134.71 164.1 34.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.339 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -116.13 -175.87 2.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.916 0.389 . . . . 0.0 111.486 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.533 ' HD3' ' HA ' ' A' ' 11' ' ' TRP . 13.9 mmtt -64.67 -48.17 75.72 Favored 'General case' 0 C--N 1.334 -0.097 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -112.8 -4.72 13.96 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 73.0 tt0 -58.51 143.03 47.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.905 0.384 . . . . 0.0 111.422 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.647 ' HG2' HG23 ' A' ' 8' ' ' ILE . 90.7 mtt180 -99.74 126.12 45.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.628 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.582 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.3 mm? -114.67 146.45 40.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.002 0.429 . . . . 0.0 111.731 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -103.5 107.03 17.7 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.268 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.55 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 66.3 mt -72.9 148.54 44.26 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.117 0.485 . . . . 0.0 111.652 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -111.97 -29.01 7.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.023 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -158.97 116.97 2.86 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.52 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.454 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 36.6 p-10 -111.26 9.31 21.71 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.2 p -70.28 -36.71 74.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.919 0.39 . . . . 0.0 111.181 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -85.13 155.93 21.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.557 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -35.39 61.36 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.5 m95 -95.62 135.34 37.43 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.454 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 41.9 m0 -109.13 133.17 53.36 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -177.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.433 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 46.4 ttt180 -87.53 134.44 33.61 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.969 HG13 HD23 ' A' ' 21' ' ' LEU . 1.5 p -145.78 157.35 12.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.824 -178.057 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.41 ' CB ' HG22 ' A' ' 48' ' ' THR . 37.8 ttm180 -121.27 143.46 49.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.389 -179.077 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.828 ' HB2' HD21 ' A' ' 21' ' ' LEU . 54.3 t30 -113.49 161.74 16.99 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.372 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.94 -21.33 29.25 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.546 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.76 5.76 10.54 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.9 m120 68.54 23.73 7.24 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 120.841 0.353 . . . . 0.0 111.046 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.509 ' O ' HD13 ' A' ' 21' ' ' LEU . 40.9 ttm180 -108.86 128.54 55.0 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.121 -0.491 . . . . 0.0 109.816 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.41 HG22 ' CB ' ' A' ' 42' ' ' ARG . 81.7 p -119.67 150.41 40.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.067 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.461 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -169.23 171.68 43.14 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.459 -0.876 . . . . 0.0 113.217 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.5 m-85 -102.68 106.37 17.0 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.574 0.225 . . . . 0.0 111.493 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.698 HG11 ' O ' ' A' ' 21' ' ' LEU . 11.1 m -123.08 119.21 27.8 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.327 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -77.31 33.11 0.43 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.147 1.898 . . . . 0.0 112.067 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.8 p -59.1 100.78 0.08 Allowed 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.644 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -81.4 -4.65 56.39 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 177.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -72.65 -7.61 51.21 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.538 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.601 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.7 p -118.81 142.43 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 CA-C-O 120.936 0.398 . . . . 0.0 110.563 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -141.32 161.22 38.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.754 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.626 ' HA ' HG12 ' A' ' 7' ' ' VAL . 27.5 ttm180 -69.93 134.72 48.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.027 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.518 ' HD2' HD12 ' A' ' 8' ' ' ILE . 79.8 tttt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.791 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.2 mtm . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.883 0.373 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.1 p -75.99 156.34 34.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.05 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -95.43 131.11 41.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.928 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -100.89 140.3 35.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.069 0.461 . . . . 0.0 111.421 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.481 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.0 t -117.87 132.61 67.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.304 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mm -103.21 109.86 28.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.414 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.416 HG12 ' CA ' ' A' ' 58' ' ' ARG . 13.1 m -128.85 162.23 36.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.771 0.319 . . . . 0.0 111.444 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.591 ' C ' HG23 ' A' ' 56' ' ' VAL . 22.8 mt -124.06 122.89 65.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.821 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.59 117.03 17.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.391 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -91.53 -5.35 54.27 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.572 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.2 m-90 -144.65 142.04 29.81 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.906 0.384 . . . . 0.0 110.528 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -70.09 120.39 15.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.584 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.432 ' HB3' HD11 ' A' ' 23' ' ' ILE . 49.4 t80 -127.27 134.13 50.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.556 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.3 m -101.25 141.95 33.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.942 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.662 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.06 135.56 56.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.703 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -83.27 -4.52 58.51 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.074 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.04 168.47 19.93 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.071 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -73.82 -35.34 64.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.443 . . . . 0.0 112.171 -178.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -76.15 -9.72 58.85 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.346 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.662 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -82.4 -178.52 7.09 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.008 0.432 . . . . 0.0 110.855 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.824 HD21 ' HB2' ' A' ' 43' ' ' ASN . 8.9 tp -122.82 138.94 54.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.79 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -83.0 149.08 27.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.439 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.528 HG22 HD11 ' A' ' 29' ' ' LEU . 38.8 pt -134.22 160.8 41.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.332 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 56.0 mtmt -116.0 168.16 10.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.09 0.471 . . . . 0.0 111.32 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.417 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 47.3 pttt -67.36 -11.43 57.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.055 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -141.11 27.24 1.97 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.156 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.422 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 84.8 tt0 -102.44 135.64 43.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.791 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.455 ' C ' HD22 ' A' ' 29' ' ' LEU . 63.6 mtt85 -86.66 119.96 27.46 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.02 0.438 . . . . 0.0 110.852 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.58 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.3 mm? -111.05 143.1 42.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.456 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.476 ' C ' HG23 ' A' ' 41' ' ' VAL . 4.0 m-90 -104.32 105.28 15.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.325 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.481 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 25.3 mt -80.64 148.79 30.09 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.929 0.395 . . . . 0.0 111.091 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.3 mp -110.19 -26.17 9.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.213 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -158.59 115.44 2.79 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.767 0.318 . . . . 0.0 111.042 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 31.9 p-10 -112.24 16.76 19.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.828 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.0 p -78.95 -36.68 41.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.988 0.423 . . . . 0.0 110.976 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -85.29 161.58 19.46 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.771 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 20.7 p -55.74 -41.03 73.34 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.407 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 49.8 m95 -92.48 133.45 35.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.165 178.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.44 ' CE3' HD13 ' A' ' 31' ' ' LEU . 38.4 m0 -106.89 132.59 52.67 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -86.97 132.94 33.64 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.58 HG21 ' HB3' ' A' ' 29' ' ' LEU . 4.2 p -149.0 155.32 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -177.676 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.412 ' CB ' HG22 ' A' ' 48' ' ' THR . 80.2 ttt180 -124.07 147.15 48.1 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.942 0.401 . . . . 0.0 111.691 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.824 ' HB2' HD21 ' A' ' 21' ' ' LEU . 39.7 t30 -111.19 164.69 12.61 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.699 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.78 -17.99 61.97 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.677 177.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.501 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -81.18 5.89 15.56 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.011 179.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 68.31 25.18 7.15 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.773 0.32 . . . . 0.0 111.713 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.548 ' O ' HD13 ' A' ' 21' ' ' LEU . 82.1 mtt85 -111.56 128.72 56.12 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.412 HG22 ' CB ' ' A' ' 42' ' ' ARG . 77.8 p -117.42 153.87 32.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.967 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.475 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -171.87 168.83 41.96 Favored Glycine 0 CA--C 1.524 0.635 0 C-N-CA 120.512 -0.852 . . . . 0.0 113.567 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -103.33 105.91 16.3 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.593 HG11 ' O ' ' A' ' 21' ' ' LEU . 5.1 m -127.19 112.85 21.56 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 111.604 0.224 . . . . 0.0 111.604 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.407 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 11.8 Cg_exo -71.16 36.23 0.29 Allowed 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 122.6 2.2 . . . . 0.0 112.683 178.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.475 ' OG ' HD11 ' A' ' 23' ' ' ILE . 41.8 t -67.0 93.45 0.28 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.022 0.439 . . . . 0.0 111.897 -178.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -71.07 -9.71 58.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.365 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.572 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.7 m-85 -64.38 -13.34 50.27 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.993 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.591 HG23 ' C ' ' A' ' 8' ' ' ILE . 5.8 p -116.16 143.72 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.12 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -148.56 160.29 43.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.896 0.379 . . . . 0.0 111.357 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.416 ' CA ' HG12 ' A' ' 7' ' ' VAL . 64.4 ttt-85 -72.27 134.81 45.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.4 mttt . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.522 179.134 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 120.84 0.353 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.0 t -94.2 -1.07 54.69 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.835 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -98.83 138.52 35.84 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.826 0.346 . . . . 0.0 111.069 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -101.09 139.64 36.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.243 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.528 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.0 t -109.52 127.68 66.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.358 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 8.1 mt -103.91 120.39 54.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.388 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.743 HG12 ' CA ' ' A' ' 58' ' ' ARG . 21.0 m -132.41 160.03 42.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.571 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.678 ' C ' HG23 ' A' ' 56' ' ' VAL . 51.7 mt -117.82 122.75 70.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.08 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.512 ' N ' HG23 ' A' ' 56' ' ' VAL . . . -74.84 122.2 23.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.139 0.495 . . . . 0.0 111.71 -178.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -91.39 -2.81 57.21 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.38 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.585 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 8.4 m-90 -145.66 143.51 29.86 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.779 0.323 . . . . 0.0 110.949 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.9 p-10 -72.4 122.71 21.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.198 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.448 ' HE1' HG13 ' A' ' 51' ' ' VAL . 62.4 t80 -128.39 140.47 51.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.17 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.3 m -100.82 136.18 41.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.61 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.792 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -56.97 134.67 55.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.351 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -65.73 -34.33 77.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.086 0.469 . . . . 0.0 110.272 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -128.8 168.38 15.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.233 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -68.01 -34.34 76.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.978 0.418 . . . . 0.0 111.164 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -62.89 -26.26 68.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.085 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.792 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -80.64 -178.68 6.86 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.493 HD12 ' C ' ' A' ' 20' ' ' GLU . 7.3 mp -124.62 145.52 49.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.587 -178.132 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -83.64 149.81 26.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.028 178.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.435 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 43.8 pt -130.79 166.12 29.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.159 179.224 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -120.3 166.76 13.07 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.287 0.565 . . . . 0.0 110.962 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 21.2 pttp -66.61 -12.9 60.1 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.739 -179.256 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -135.4 22.07 3.42 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.208 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -101.08 143.42 31.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.875 0.369 . . . . 0.0 110.592 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.559 ' C ' HD22 ' A' ' 29' ' ' LEU . 26.3 ptt85 -102.86 128.35 49.67 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.935 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.559 HD22 ' C ' ' A' ' 28' ' ' ARG . 0.7 OUTLIER -115.81 151.76 34.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.189 -178.968 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 8.7 m-90 -100.51 110.63 22.81 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.046 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.528 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 86.7 mt -75.41 145.65 41.41 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.946 0.403 . . . . 0.0 111.573 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.607 HD13 ' HG2' ' A' ' 40' ' ' ARG . 5.3 mp -111.69 -29.87 7.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.007 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -161.02 119.86 2.53 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.863 0.363 . . . . 0.0 110.952 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.44 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.4 p-10 -106.44 1.97 26.0 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.3 m -64.9 -39.17 93.11 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -81.32 158.79 24.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.195 0.521 . . . . 0.0 112.192 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 94.2 m -58.64 -36.22 73.77 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.024 178.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.498 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 21.1 m95 -99.37 125.41 45.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.44 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 41.7 m0 -95.11 138.98 32.09 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -177.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.607 ' HG2' HD13 ' A' ' 32' ' ' LEU . 34.9 ttm180 -92.8 136.27 33.39 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 177.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.579 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.8 OUTLIER -141.51 159.68 21.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.834 -178.325 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -121.6 145.06 48.36 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.242 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.445 ' HB2' HD23 ' A' ' 21' ' ' LEU . 52.0 t30 -111.0 162.76 14.53 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.934 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.12 -23.15 45.06 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.852 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.52 5.46 7.32 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 179.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.3 m120 71.33 26.6 3.3 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 120.874 0.369 . . . . 0.0 110.714 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.403 ' C ' HD21 ' A' ' 21' ' ' LEU . 25.9 mmt85 -106.34 145.75 31.28 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.765 178.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.4 p -135.21 148.84 49.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.723 0.297 . . . . 0.0 111.135 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 40' ' ' ARG . . . -171.15 -172.03 36.95 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.851 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -108.89 112.35 24.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.712 0.291 . . . . 0.0 111.419 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.448 HG13 ' HE1' ' A' ' 13' ' ' TYR . 21.7 t -127.09 113.3 21.74 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.416 178.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.498 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 59.9 Cg_endo -76.94 31.11 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.414 2.076 . . . . 0.0 112.484 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.662 ' O ' HG12 ' A' ' 56' ' ' VAL . 13.8 p -62.43 87.24 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.772 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -72.86 -8.12 54.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.517 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.585 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 99.6 m-85 -71.79 -1.29 13.54 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.678 HG23 ' C ' ' A' ' 8' ' ' ILE . 6.5 p -111.04 144.78 18.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-O 120.877 0.37 . . . . 0.0 110.922 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -136.03 148.79 48.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.988 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.743 ' CA ' HG12 ' A' ' 7' ' ' VAL . 78.2 ttt-85 -70.43 138.97 51.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.868 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 62.3 tttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.861 179.638 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.9 mtm . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.826 0.345 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 4' ' ' GLU . 42.5 m -77.79 129.42 35.44 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.718 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -91.64 -3.14 56.69 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.798 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.632 ' H ' HG22 ' A' ' 2' ' ' THR . 99.4 mt-10 -94.33 139.67 30.79 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.165 0.507 . . . . 0.0 111.154 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.462 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.7 t -114.41 130.02 69.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.369 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.9 mt -104.5 121.08 55.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.842 0.353 . . . . 0.0 110.939 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.761 HG12 ' HA ' ' A' ' 58' ' ' ARG . 27.2 m -132.34 162.72 39.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.964 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.751 HG23 ' HG2' ' A' ' 28' ' ' ARG . 24.3 mt -116.76 128.46 74.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.642 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.482 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.63 146.75 44.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.037 0.446 . . . . 0.0 111.119 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.419 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 30.9 mtpp -110.25 -21.9 12.01 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.328 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.517 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.9 m-90 -137.47 142.08 41.55 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.164 0.507 . . . . 0.0 110.975 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -65.37 127.1 30.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.535 -179.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.467 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 68.0 t80 -128.47 140.24 51.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.707 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.9 m -101.91 134.12 45.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.737 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.788 ' HB1' ' HG3' ' A' ' 20' ' ' GLU . . . -51.87 128.23 23.4 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.35 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -67.82 -24.26 65.27 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.953 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -146.42 171.47 14.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.919 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -67.19 -35.04 78.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.928 0.394 . . . . 0.0 111.585 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -58.17 -40.43 81.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.058 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.788 ' HG3' ' HB1' ' A' ' 15' ' ' ALA . 5.5 pt-20 -83.41 -179.55 7.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.075 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.653 HD21 ' CB ' ' A' ' 47' ' ' ARG . 8.6 mp -122.22 162.26 21.72 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -89.33 144.43 26.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.92 178.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.597 HG22 HD11 ' A' ' 29' ' ' LEU . 34.6 pt -128.95 163.98 32.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.815 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.438 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 96.4 mttt -111.94 -179.12 3.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.339 0.59 . . . . 0.0 111.442 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 32.9 ttmt -61.8 -51.99 66.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.808 -179.062 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -105.82 -7.46 18.29 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.438 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 74.9 tt0 -54.03 145.2 17.29 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.036 0.446 . . . . 0.0 111.363 -179.48 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.751 ' HG2' HG23 ' A' ' 8' ' ' ILE . 99.4 mtt180 -101.95 125.87 48.73 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.531 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.676 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.0 OUTLIER -114.6 146.88 40.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.33 -179.165 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -100.91 111.65 23.9 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.172 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.585 HD23 HG23 ' A' ' 41' ' ' VAL . 83.0 mt -76.32 143.73 40.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.758 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.529 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -111.46 -28.25 8.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.909 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -160.97 120.31 2.61 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.116 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.436 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 94.4 m-20 -109.17 5.2 23.69 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.942 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 t -69.62 -35.98 75.74 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.846 0.355 . . . . 0.0 111.427 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -83.23 157.4 22.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.668 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 90.5 m -56.83 -35.78 69.21 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 16.3 m95 -98.89 131.54 44.9 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.436 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 43.5 m0 -101.47 134.25 44.85 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.419 0.525 . . . . 0.0 112.419 -177.378 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.439 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 46.2 ttt85 -88.08 131.81 34.54 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.337 178.393 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.676 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -133.31 163.4 37.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.601 -178.522 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -126.77 140.9 52.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.367 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -108.82 162.99 13.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.823 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.73 -22.75 58.45 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.551 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.76 4.45 9.6 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.9 t30 74.31 24.17 1.91 Allowed 'General case' 0 C--N 1.342 0.258 0 C-N-CA 122.505 0.322 . . . . 0.0 110.952 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.653 ' CB ' HD21 ' A' ' 21' ' ' LEU . 95.4 mtt-85 -105.59 142.83 34.65 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.097 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 78.4 p -132.82 147.05 52.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.803 0.335 . . . . 0.0 111.277 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.476 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -170.31 176.83 43.83 Favored Glycine 0 CA--C 1.523 0.567 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.557 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.439 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 96.1 m-85 -103.13 99.39 9.26 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.075 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.739 HG22 ' HB2' ' A' ' 20' ' ' GLU . 19.8 t -108.1 111.83 61.78 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.294 179.061 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.86 32.93 0.33 Allowed 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.132 1.888 . . . . 0.0 112.448 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.45 ' O ' HG12 ' A' ' 56' ' ' VAL . 15.8 p -65.04 91.69 0.1 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.793 0.33 . . . . 0.0 111.344 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -72.6 -7.4 50.03 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.971 178.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.517 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.4 m-85 -66.81 -10.22 45.48 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.861 0.465 . . . . 0.0 112.231 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.622 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.5 p -115.49 143.63 24.92 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.122 0 CA-C-O 121.025 0.441 . . . . 0.0 110.805 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.28 157.24 46.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.528 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.761 ' HA ' HG12 ' A' ' 7' ' ' VAL . 73.8 ttp85 -79.73 132.08 36.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.95 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.3 mtmm . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.316 -0.849 . . . . 0.0 110.891 179.832 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.8 mtt . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.662 0.267 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 71.5 p -89.12 -0.65 57.61 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.882 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -101.07 133.62 45.31 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-O 120.904 0.383 . . . . 0.0 111.221 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -98.82 138.67 35.63 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.766 179.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.529 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 63.5 t -111.29 130.39 64.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.676 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.5 mt -104.07 121.0 55.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.286 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.605 HG12 ' HA ' ' A' ' 58' ' ' ARG . 22.2 m -132.55 162.35 39.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.809 0.338 . . . . 0.0 111.685 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.746 HG23 ' HG2' ' A' ' 28' ' ' ARG . 15.7 mt -123.62 120.61 60.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.85 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.506 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.6 129.24 37.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.643 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -95.32 -6.57 40.93 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.367 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.511 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.1 m-90 -147.34 142.25 26.91 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.848 0.356 . . . . 0.0 110.85 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.43 122.25 20.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.42 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.404 ' CE1' ' O ' ' A' ' 14' ' ' THR . 60.2 t80 -127.46 138.37 52.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.511 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.404 ' O ' ' CE1' ' A' ' 13' ' ' TYR . 27.2 m -98.37 139.63 33.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.9 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.757 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -53.45 128.02 27.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.754 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -61.46 -33.0 73.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.204 0.526 . . . . 0.0 110.426 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -135.76 162.0 33.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.699 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -59.17 -35.69 73.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.918 0.39 . . . . 0.0 111.659 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -66.06 -20.29 66.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.6 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.757 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.3 mm-40 -81.74 -179.83 7.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.948 0.404 . . . . 0.0 110.259 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.744 HD21 ' HB2' ' A' ' 43' ' ' ASN . 9.2 tp -120.21 145.59 46.85 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.681 -178.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -86.71 146.35 26.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.575 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.479 HG22 ' HG ' ' A' ' 29' ' ' LEU . 29.5 pt -131.13 164.29 34.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.106 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -121.59 168.9 11.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.233 0.539 . . . . 0.0 111.067 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.485 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 53.9 pttt -67.1 -15.27 63.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.386 -0.824 . . . . 0.0 113.162 -178.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -139.01 23.61 2.59 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.534 -0.466 . . . . 0.0 111.213 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -99.85 139.1 36.0 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.113 0.482 . . . . 0.0 110.641 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.746 ' HG2' HG23 ' A' ' 8' ' ' ILE . 60.6 mtt85 -92.65 121.43 34.07 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.76 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.507 HD22 ' C ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -113.92 150.07 34.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.875 0.369 . . . . 0.0 110.683 -179.607 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -102.71 113.53 27.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.404 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.529 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 61.0 mt -78.78 143.41 36.12 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.053 0.454 . . . . 0.0 111.28 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -107.82 -28.18 9.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.78 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -159.1 117.05 2.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.947 0.403 . . . . 0.0 110.889 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.448 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.9 p-10 -107.0 1.61 24.53 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.047 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.5 t -67.13 -37.76 84.39 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.88 0.371 . . . . 0.0 111.517 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -81.06 159.51 24.74 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.67 0.748 . . . . 0.0 112.779 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 16.9 p -56.96 -39.9 75.47 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.255 178.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -97.15 132.67 42.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.79 -1.095 . . . . 0.0 108.366 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.448 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 36.1 m0 -102.2 136.66 41.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -177.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 44.2 ttt180 -93.49 137.78 32.43 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 177.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.51 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -142.37 162.53 18.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.701 -0.4 . . . . 0.0 111.263 -178.316 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.43 ' HG3' HG22 ' A' ' 48' ' ' THR . 65.7 ttt180 -125.04 143.41 50.93 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.041 0.448 . . . . 0.0 111.891 -178.212 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.744 ' HB2' HD21 ' A' ' 21' ' ' LEU . 59.9 t30 -110.61 164.64 12.53 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.923 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.61 -22.97 64.34 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.804 178.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.97 5.33 11.91 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.043 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 67.82 26.56 7.63 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.95 0.405 . . . . 0.0 111.271 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.537 ' O ' HD13 ' A' ' 21' ' ' LEU . 27.1 ttm180 -110.4 127.65 55.19 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.332 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.43 HG22 ' HG3' ' A' ' 42' ' ' ARG . 37.3 p -122.72 152.62 40.4 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.832 0.349 . . . . 0.0 110.997 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.421 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -168.22 173.1 43.01 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.524 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -100.92 107.16 18.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.916 0.389 . . . . 0.0 111.17 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.724 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.3 t -119.75 113.91 34.39 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.058 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.08 42.81 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 121.804 1.669 . . . . 0.0 111.82 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.472 ' O ' HG12 ' A' ' 56' ' ' VAL . 2.8 p -70.62 88.45 0.69 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.096 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -66.54 -13.98 61.71 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.124 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.511 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.8 m-85 -61.67 -15.45 40.2 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.506 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.4 p -107.07 141.85 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 120.984 0.421 . . . . 0.0 110.451 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -127.44 151.35 48.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.768 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.605 ' HA ' HG12 ' A' ' 7' ' ' VAL . 76.4 mtp180 -69.57 139.9 53.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.836 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.537 ' HZ3' ' HB ' ' A' ' 8' ' ' ILE . 20.1 pttm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.909 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.5 mtm . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 120.95 0.405 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.7 t -98.33 123.23 42.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.406 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -98.39 127.82 44.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.636 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -80.01 144.48 33.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.002 0.43 . . . . 0.0 110.953 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.448 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 77.9 t -116.13 133.88 61.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.949 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.5 mt -115.01 114.42 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.409 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.642 HG12 ' HA ' ' A' ' 58' ' ' ARG . 32.2 m -130.68 163.72 35.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.776 0.322 . . . . 0.0 111.55 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.598 ' C ' HG23 ' A' ' 56' ' ' VAL . 13.7 mt -121.94 121.93 65.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.413 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.601 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -78.45 120.26 22.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.677 -179.618 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -91.11 -7.71 50.88 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.562 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.642 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.8 m-90 -143.57 143.18 31.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.956 0.408 . . . . 0.0 110.705 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -72.08 120.47 17.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.129 0.49 . . . . 0.0 111.751 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.465 ' HB3' HD11 ' A' ' 23' ' ' ILE . 60.1 t80 -128.26 134.7 49.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.766 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.8 m -100.83 138.69 37.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.488 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.649 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -56.54 132.51 51.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.491 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.437 ' HB2' ' OE2' ' A' ' 20' ' ' GLU . 99.0 mm-40 -69.96 -16.06 63.14 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.998 179.191 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -141.64 172.89 12.06 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -74.38 -34.3 63.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.264 0.554 . . . . 0.0 110.533 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.77 -19.13 64.74 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.135 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.649 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -86.4 -179.85 6.74 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.635 -179.264 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.99 HD21 ' HB2' ' A' ' 43' ' ' ASN . 28.6 tp -122.1 130.72 53.5 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -177.18 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -71.23 142.24 50.58 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.194 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.465 HD11 ' HB3' ' A' ' 13' ' ' TYR . 38.1 pt -129.03 164.48 31.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.374 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 66.5 mttm -120.98 167.02 13.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.227 0.537 . . . . 0.0 111.366 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 56.2 pttt -66.84 -12.91 60.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.334 -0.848 . . . . 0.0 113.101 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -141.52 28.35 1.82 Allowed 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 72.5 tt0 -105.09 140.57 38.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.085 0.469 . . . . 0.0 110.928 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.488 ' C ' HD22 ' A' ' 29' ' ' LEU . 66.4 mtp180 -92.46 119.12 31.66 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.184 -179.564 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.551 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.5 mm? -112.23 150.91 30.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.511 -179.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -107.2 106.49 16.99 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.612 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.511 ' HA ' HG23 ' A' ' 41' ' ' VAL . 39.3 mt -76.06 149.67 37.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.44 0.638 . . . . 0.0 111.334 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -112.19 -30.43 7.21 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.643 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.1 m-20 -157.04 113.91 3.05 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.529 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.454 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -106.49 2.47 26.29 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -65.18 -37.9 88.8 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 120.843 0.354 . . . . 0.0 111.308 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -82.58 158.21 23.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.545 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -34.59 69.6 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.383 0.611 . . . . 0.0 109.383 178.083 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.475 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 37.4 m95 -96.21 129.84 43.42 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 114.985 -1.007 . . . . 0.0 108.703 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.454 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 38.6 m0 -104.11 132.53 50.27 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -177.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -90.03 131.06 36.11 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 177.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.647 HG13 HD23 ' A' ' 21' ' ' LEU . 0.7 OUTLIER -142.5 157.63 19.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.41 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.479 ' CB ' HG22 ' A' ' 48' ' ' THR . 36.5 ttp180 -123.59 141.85 51.61 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.707 -179.028 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.99 ' HB2' HD21 ' A' ' 21' ' ' LEU . 51.7 t30 -113.15 162.45 15.95 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.016 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.03 -18.91 15.85 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.882 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.71 5.27 11.56 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 67.39 26.05 8.49 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-O 120.852 0.358 . . . . 0.0 111.065 -179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -115.25 125.81 53.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.812 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.479 HG22 ' CB ' ' A' ' 42' ' ' ARG . 60.3 p -116.81 151.44 36.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.878 0.371 . . . . 0.0 111.032 -179.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.538 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.25 168.38 38.63 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.197 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -102.37 102.65 13.01 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.432 HG13 ' HB3' ' A' ' 20' ' ' GLU . 6.3 m -120.08 122.99 28.59 Favored Pre-proline 0 C--N 1.325 -0.479 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.729 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.475 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 84.2 Cg_endo -80.62 29.28 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.25 1.967 . . . . 0.0 112.333 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.407 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -58.66 91.89 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.3 -179.382 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -68.96 -12.7 61.9 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.059 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.642 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 99.1 m-85 -63.8 -13.79 47.31 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.424 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.601 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.2 p -113.39 142.4 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-O 121.023 0.44 . . . . 0.0 110.579 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -140.61 157.87 44.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.522 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.642 ' HA ' HG12 ' A' ' 7' ' ' VAL . 36.5 ttm180 -69.67 137.74 52.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.9 0.381 . . . . 0.0 110.804 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.4 tttt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.802 -179.78 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.5 mtp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.822 0.344 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 80.5 p -73.49 154.79 39.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.06 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -92.19 136.48 33.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.001 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -98.44 139.95 33.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.034 0.445 . . . . 0.0 111.112 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.7 t -114.88 128.28 72.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.891 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.5 mt -104.28 116.26 47.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.911 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 58' ' ' ARG . 26.4 m -130.83 163.07 37.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.983 0.42 . . . . 0.0 111.653 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.527 HD12 ' HD2' ' A' ' 59' ' ' LYS . 13.9 mt -123.65 133.49 69.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.019 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.433 ' HB1' HD12 ' A' ' 23' ' ' ILE . . . -80.33 137.01 36.51 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.675 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -102.74 7.45 39.66 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.696 ' CE3' ' HB2' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -163.06 151.18 13.78 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.805 0.336 . . . . 0.0 110.506 178.726 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.421 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 43.3 t0 -79.11 113.68 17.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.031 0.444 . . . . 0.0 111.91 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.492 ' HB2' ' CE2' ' A' ' 11' ' ' TRP . 56.4 t80 -127.57 145.79 50.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.16 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.9 t -105.75 135.22 47.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.373 178.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.722 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -52.75 139.24 27.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.476 . . . . 0.0 112.025 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -64.52 -31.34 72.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.071 0.463 . . . . 0.0 109.817 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -136.73 165.29 26.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.614 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -62.91 -27.89 69.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.861 0.362 . . . . 0.0 110.97 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -68.05 -26.21 65.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.14 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.722 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -89.08 176.92 6.79 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.595 ' O ' HG11 ' A' ' 51' ' ' VAL . 6.7 mp -128.01 141.55 51.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.999 0.428 . . . . 0.0 111.275 -179.294 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.0 p-10 -79.17 157.81 27.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.36 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.649 HG22 ' HG ' ' A' ' 29' ' ' LEU . 44.5 pt -127.93 155.48 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.028 179.262 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 95.4 mttt -111.25 172.45 6.87 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.845 0.355 . . . . 0.0 111.049 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.498 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 19.5 pttp -68.01 -12.96 61.77 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -178.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -151.97 29.38 0.58 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.477 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 59.2 tt0 -98.77 142.06 30.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.84 0.352 . . . . 0.0 110.961 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.507 ' C ' HD22 ' A' ' 29' ' ' LEU . 35.5 mtm-85 -92.3 121.59 33.95 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.404 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.649 ' HG ' HG22 ' A' ' 23' ' ' ILE . 0.6 OUTLIER -116.09 149.02 39.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.713 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -100.42 107.25 18.95 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.964 0.411 . . . . 0.0 110.743 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.576 HD21 ' HB3' ' A' ' 39' ' ' TRP . 0.1 OUTLIER -86.48 152.02 23.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.309 0.576 . . . . 0.0 112.444 -178.651 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.42 HD22 ' NH1' ' A' ' 40' ' ' ARG . 3.2 mp -114.0 -22.38 10.1 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.395 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -163.05 120.61 1.94 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.822 0.344 . . . . 0.0 110.815 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.506 ' HB3' HD22 ' A' ' 31' ' ' LEU . 30.1 p-10 -117.26 19.38 14.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.1 t -81.57 -34.99 30.71 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.741 0.305 . . . . 0.0 111.368 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.4 mmtm -86.87 160.9 18.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.925 0.393 . . . . 0.0 111.624 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 28.8 m -57.09 -33.98 67.85 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 121.352 0.596 . . . . 0.0 109.654 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.434 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 17.5 m95 -99.31 126.38 45.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.587 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.576 ' HB3' HD21 ' A' ' 31' ' ' LEU . 37.7 m0 -99.1 132.06 44.68 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.42 ' NH1' HD22 ' A' ' 32' ' ' LEU . 35.1 ttt180 -88.02 125.78 34.73 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.315 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.569 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.8 p -136.9 162.12 34.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -177.649 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.472 ' HG3' HG22 ' A' ' 48' ' ' THR . 79.1 ttt180 -130.38 148.44 52.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.15 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -117.0 171.52 7.86 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.135 0.493 . . . . 0.0 112.034 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.2 -18.21 60.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.869 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.81 6.47 10.91 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 67.63 24.1 8.59 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 120.899 0.381 . . . . 0.0 111.14 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.578 ' O ' HD21 ' A' ' 21' ' ' LEU . 99.4 mtt180 -111.03 128.37 55.84 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.861 178.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.472 HG22 ' HG3' ' A' ' 42' ' ' ARG . 16.5 p -113.66 159.11 20.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.513 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.506 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -175.1 176.75 47.21 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.18 -1.009 . . . . 0.0 113.347 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 65.2 m-85 -115.99 110.51 19.04 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.595 HG11 ' O ' ' A' ' 21' ' ' LEU . 0.3 OUTLIER -122.99 127.68 25.61 Favored Pre-proline 0 CA--C 1.532 0.251 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.618 178.308 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.434 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 76.7 Cg_endo -76.43 58.6 5.84 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.114 1.876 . . . . 0.0 111.765 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.3 p -66.97 94.36 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -60.42 -60.55 3.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.05 0.452 . . . . 0.0 109.951 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.696 ' HB2' ' CE3' ' A' ' 11' ' ' TRP . 19.5 m-85 -84.35 97.39 9.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 122.582 1.182 . . . . 0.0 113.431 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.1 p -155.45 140.84 10.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.698 177.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -121.43 134.7 55.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.832 0.349 . . . . 0.0 111.679 -178.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.435 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 67.9 ttp85 -78.56 133.42 37.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.867 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.527 ' HD2' HD12 ' A' ' 8' ' ' ILE . 22.1 mttm . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.007 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mtm . . . . . 0 N--CA 1.488 1.449 0 CA-C-O 120.832 0.348 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 81.1 p -89.8 0.4 57.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.729 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -66.53 -33.32 75.43 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-O 121.079 0.466 . . . . 0.0 110.989 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.44 137.48 39.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.122 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 30' ' ' TRP . 57.3 t -114.6 130.05 69.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.482 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 8.2 mt -106.14 116.71 50.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.766 0.317 . . . . 0.0 111.297 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.528 HG12 ' CB ' ' A' ' 58' ' ' ARG . 34.8 m -131.33 161.21 41.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.215 179.476 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.583 HG23 ' HG2' ' A' ' 28' ' ' ARG . 18.9 mt -122.41 126.3 73.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.78 179.565 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.624 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.77 144.94 41.13 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.941 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -110.14 -25.68 10.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.335 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.491 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 8.3 m-90 -133.36 137.63 45.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -61.98 122.05 14.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.621 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.446 ' HB3' HD11 ' A' ' 23' ' ' ILE . 53.2 t80 -127.09 137.35 53.0 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.648 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.7 m -105.94 137.67 43.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.553 179.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.735 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -53.4 142.58 21.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.218 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -88.24 -8.31 55.46 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.272 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -149.12 167.54 25.65 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.646 0.26 . . . . 0.0 110.508 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -68.14 -29.27 68.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.335 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -77.22 -11.33 59.81 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.863 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.735 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -89.69 179.26 6.06 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.86 HD21 ' HB2' ' A' ' 43' ' ' ASN . 44.0 tp -121.7 134.63 54.96 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.026 0.441 . . . . 0.0 111.71 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -77.11 144.47 38.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.853 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.446 HD11 ' HB3' ' A' ' 13' ' ' TYR . 23.1 pt -131.83 164.66 34.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.109 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -113.13 -177.03 3.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.952 0.406 . . . . 0.0 111.284 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -64.91 -51.49 61.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.586 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -109.83 -5.6 15.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -57.05 144.63 33.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.813 0.34 . . . . 0.0 111.25 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.583 ' HG2' HG23 ' A' ' 8' ' ' ILE . 81.8 mtm180 -97.63 124.35 41.88 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.63 179.509 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.655 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.8 mm? -111.59 147.13 36.12 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.895 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.41 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 6.2 m-90 -104.33 104.24 14.1 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.144 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.915 HD11 ' HB3' ' A' ' 39' ' ' TRP . 0.5 OUTLIER -72.23 147.63 46.3 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.3 0.572 . . . . 0.0 112.259 -179.057 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.2 mp -109.82 -26.68 9.68 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.976 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -160.99 118.16 2.33 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.808 0.337 . . . . 0.0 111.257 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.44 ' OD2' ' HG ' ' A' ' 31' ' ' LEU . 97.0 m-20 -105.61 3.62 29.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.159 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 57.7 m -68.57 -35.36 77.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.708 0.289 . . . . 0.0 111.721 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -85.68 156.48 20.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.257 0.551 . . . . 0.0 112.264 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 58.6 m -57.72 -31.8 66.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.188 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.485 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 7.4 m0 -100.26 132.99 45.32 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.915 ' HB3' HD11 ' A' ' 31' ' ' LEU . 23.5 m0 -100.69 128.97 46.55 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -176.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.805 ' O ' HD13 ' A' ' 31' ' ' LEU . 72.6 ttt180 -87.94 122.82 32.01 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.084 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.812 HG13 HD23 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -138.45 151.09 24.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 120.475 -0.49 . . . . 0.0 112.219 -177.835 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.451 ' CB ' ' HB ' ' A' ' 48' ' ' THR . 24.4 ttp-105 -121.92 146.72 46.85 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.3 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.86 ' HB2' HD21 ' A' ' 21' ' ' LEU . 57.6 t30 -116.05 164.6 14.22 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.363 -179.275 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.38 -18.26 16.72 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.867 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.89 4.78 11.11 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.3 t30 72.64 21.59 3.48 Favored 'General case' 0 C--N 1.339 0.116 0 CA-C-O 120.859 0.361 . . . . 0.0 111.302 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.457 ' O ' HD13 ' A' ' 21' ' ' LEU . 95.6 mtt180 -114.8 130.49 56.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.905 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.451 ' HB ' ' CB ' ' A' ' 42' ' ' ARG . 12.2 t -141.34 143.17 33.87 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.778 -179.468 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.455 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.47 178.64 39.64 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.371 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.4 m-85 -93.38 113.17 25.28 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.632 0.253 . . . . 0.0 111.512 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.516 HG13 ' HB3' ' A' ' 20' ' ' GLU . 4.6 m -127.46 120.94 22.21 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.846 -0.161 . . . . 0.0 111.263 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.485 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 6.3 Cg_exo -72.33 30.92 0.27 Allowed 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.421 2.081 . . . . 0.0 112.091 177.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.456 ' O ' HG12 ' A' ' 56' ' ' VAL . 8.4 t -66.0 85.51 0.09 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 120.897 0.379 . . . . 0.0 111.135 -179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 p30 -69.09 -9.97 55.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.422 178.252 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.491 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 80.9 m-85 -65.2 -10.63 33.03 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.624 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.6 p -115.03 141.48 31.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.909 0.385 . . . . 0.0 110.735 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -137.73 150.4 47.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.725 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.528 ' CB ' HG12 ' A' ' 7' ' ' VAL . 67.7 ttt180 -69.53 140.5 53.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.802 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 93.2 mttt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.243 -0.884 . . . . 0.0 111.051 179.968 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.3 mmm . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 120.72 0.295 . . . . 0.0 111.362 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m 57.79 22.23 8.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.227 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -91.33 -9.53 44.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.938 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 85.4 tt0 -69.81 138.95 53.09 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.139 0.495 . . . . 0.0 110.562 179.512 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.424 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 59.3 t -110.9 121.83 64.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.008 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.1 mt -114.06 118.38 58.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.117 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.735 HG12 ' HA ' ' A' ' 58' ' ' ARG . 32.9 m -131.39 162.53 39.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 121.048 0.452 . . . . 0.0 111.623 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.642 HG23 ' HG2' ' A' ' 28' ' ' ARG . 10.5 mt -120.02 123.6 71.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.503 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.657 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.5 126.5 31.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.202 -179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -96.47 -10.35 27.65 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.336 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.63 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.6 m-90 -145.12 143.14 30.22 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.792 0.329 . . . . 0.0 110.577 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -67.8 125.51 26.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.096 0.474 . . . . 0.0 111.62 -178.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.467 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 58.2 t80 -127.8 138.12 52.62 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.844 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.7 t -102.74 140.28 37.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.913 0.387 . . . . 0.0 110.714 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.631 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -61.45 136.24 57.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.474 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -84.39 -3.58 58.39 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.085 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.472 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 92.8 mt-30 -145.47 171.65 14.33 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.586 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -76.44 -29.84 57.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.935 0.398 . . . . 0.0 111.283 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -75.99 -12.65 60.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.937 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.631 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -88.74 178.02 6.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.933 0.397 . . . . 0.0 110.726 -179.697 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.615 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.5 mp -124.88 139.52 53.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.77 -178.347 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -78.6 146.41 34.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.354 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.467 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 45.8 pt -129.84 161.87 38.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.473 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -114.72 166.32 11.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.768 0.318 . . . . 0.0 111.025 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.463 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 21.0 pttp -63.75 -11.32 25.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -138.45 25.95 2.62 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.289 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.439 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 83.9 tt0 -99.57 138.01 37.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.854 0.359 . . . . 0.0 110.903 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.642 ' HG2' HG23 ' A' ' 8' ' ' ILE . 75.8 mtp180 -94.1 120.67 34.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.124 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.601 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -115.21 150.06 36.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.04 -179.351 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.0 m-90 -103.43 107.15 17.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.172 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.459 ' HA ' HG23 ' A' ' 41' ' ' VAL . 89.3 mt -76.69 149.15 36.44 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.051 0.453 . . . . 0.0 111.561 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.0 mp -113.97 -28.63 7.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.036 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -160.99 118.88 2.4 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.552 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.444 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 31.3 p-10 -110.87 2.8 18.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.128 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.0 m -65.06 -36.82 85.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.828 0.347 . . . . 0.0 111.342 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -83.63 158.75 21.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.083 0.468 . . . . 0.0 111.809 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.7 m -57.44 -34.78 69.32 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.564 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 61.3 m95 -97.64 131.61 44.06 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 177.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.479 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 40.5 m0 -103.94 133.79 48.31 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -177.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.422 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 37.4 ttt180 -88.58 130.1 35.33 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.601 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.7 OUTLIER -141.04 155.52 21.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 120.915 0.388 . . . . 0.0 111.589 -178.702 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.458 ' HB2' HG22 ' A' ' 48' ' ' THR . 40.3 ttp180 -120.42 145.58 47.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.605 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -113.04 162.56 15.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.703 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.16 -21.33 46.7 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.879 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.34 5.23 10.96 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.857 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.0 t30 72.81 24.68 2.63 Favored 'General case' 0 N--CA 1.46 0.071 0 CA-C-O 120.829 0.347 . . . . 0.0 110.895 -179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.491 ' O ' HD21 ' A' ' 21' ' ' LEU . 82.5 mtm180 -108.92 136.89 47.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.434 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.458 HG22 ' HB2' ' A' ' 42' ' ' ARG . 74.8 p -124.81 152.7 43.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.729 0.299 . . . . 0.0 110.905 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -174.23 179.87 45.3 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.56 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.479 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 95.3 m-85 -110.11 113.54 26.32 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.808 0.304 . . . . 0.0 111.618 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.615 HG11 ' O ' ' A' ' 21' ' ' LEU . 29.4 m -131.21 112.02 15.59 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.587 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.564 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 74.0 Cg_endo -74.73 45.24 1.25 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.18 1.92 . . . . 0.0 111.855 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.717 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.4 p -69.61 73.63 0.38 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.038 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -53.57 -19.18 3.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.935 0.398 . . . . 0.0 110.93 178.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.63 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 77.5 m-85 -61.11 -12.83 13.66 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.221 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.717 HG12 ' O ' ' A' ' 53' ' ' SER . 11.9 p -110.36 146.15 15.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-O 120.808 0.337 . . . . 0.0 110.943 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.419 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 85.5 tt0 -142.21 164.17 30.88 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.544 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.735 ' HA ' HG12 ' A' ' 7' ' ' VAL . 18.8 mtp180 -68.69 139.28 55.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.528 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.6 tttp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.343 -0.836 . . . . 0.0 110.864 179.938 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.3 mtp . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 120.777 0.322 . . . . 0.0 110.942 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.0 t -99.58 119.96 38.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.22 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -96.68 138.14 34.7 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.86 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -98.99 138.68 35.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.159 0.504 . . . . 0.0 111.378 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.456 ' HB ' ' HB3' ' A' ' 31' ' ' LEU . 64.1 t -119.84 131.91 71.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.382 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.3 mm -100.41 110.97 28.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.807 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.754 HG12 ' HA ' ' A' ' 58' ' ' ARG . 34.6 m -128.49 155.91 40.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.767 0.318 . . . . 0.0 111.348 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.57 HD12 ' HG2' ' A' ' 28' ' ' ARG . 30.6 mm -121.29 126.98 75.68 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.874 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.564 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.96 143.14 45.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.496 -179.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.429 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 60.3 mttp -112.42 -24.34 9.8 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.753 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.6 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.3 m-90 -137.1 136.7 38.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.045 0.45 . . . . 0.0 110.552 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -59.74 120.8 10.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.394 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.516 ' HB3' HD11 ' A' ' 23' ' ' ILE . 49.3 t80 -127.22 138.39 53.1 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.144 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 86.6 m -107.06 139.64 41.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.657 179.474 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.574 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.22 135.54 56.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.713 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -87.75 0.32 55.9 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.542 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.467 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 95.8 mt-30 -147.11 167.23 24.63 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -75.05 -20.28 59.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.577 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -88.47 -8.19 55.32 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.574 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -88.54 177.53 6.76 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.658 -179.757 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.947 HD23 HG13 ' A' ' 41' ' ' VAL . 38.6 tp -119.44 128.66 54.23 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -70.4 141.69 52.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.9 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.516 HD11 ' HB3' ' A' ' 13' ' ' TYR . 35.9 pt -130.65 162.59 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.253 179.411 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 88.3 mttt -110.95 -177.27 3.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.901 0.381 . . . . 0.0 110.767 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HG3' ' HA ' ' A' ' 11' ' ' TRP . 27.6 ttpp -65.3 -48.76 72.01 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.626 -178.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -114.61 -0.25 13.71 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.443 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 66.3 tt0 -57.62 144.11 38.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.105 0.479 . . . . 0.0 111.175 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.57 ' HG2' HD12 ' A' ' 8' ' ' ILE . 89.1 mtt180 -91.49 121.67 33.39 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.467 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.726 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.7 mm? -115.28 140.65 48.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.344 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -100.89 105.26 16.51 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.793 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.672 HD11 ' HB3' ' A' ' 39' ' ' TRP . 5.6 tp -84.1 151.34 24.99 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 mp -107.92 -19.32 13.56 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.757 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -168.82 125.12 0.95 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.787 0.327 . . . . 0.0 111.326 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.418 ' HB3' HD23 ' A' ' 31' ' ' LEU . 34.1 p-10 -115.58 2.18 13.73 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.682 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.2 m -64.13 -38.33 90.65 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.791 0.329 . . . . 0.0 111.623 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -82.9 159.01 22.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.002 0.429 . . . . 0.0 111.746 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.8 m -58.94 -35.58 73.36 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.476 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 22.6 m95 -94.59 127.67 40.69 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.434 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.672 ' HB3' HD11 ' A' ' 31' ' ' LEU . 41.5 m0 -102.06 134.45 45.27 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -177.194 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.454 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 53.6 ttt180 -92.38 125.81 37.19 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.931 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.947 HG13 HD23 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -139.2 161.79 28.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -178.514 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.637 ' CB ' HG22 ' A' ' 48' ' ' THR . 53.7 ttp180 -125.81 147.58 49.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.042 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.922 ' HB3' HD21 ' A' ' 21' ' ' LEU . 47.3 p-10 -118.6 172.25 7.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.012 0.434 . . . . 0.0 111.762 -179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.37 -23.43 65.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.541 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.36 4.97 9.57 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 68.98 25.68 5.89 Favored 'General case' 0 N--CA 1.457 -0.093 0 CA-C-O 120.815 0.34 . . . . 0.0 111.012 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 55.3 mtp180 -111.09 132.46 54.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.692 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.637 HG22 ' CB ' ' A' ' 42' ' ' ARG . 80.6 p -123.49 148.28 46.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.923 -179.579 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.454 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.2 168.69 40.58 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.39 -0.909 . . . . 0.0 113.142 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.454 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 96.9 m-85 -101.14 103.91 14.98 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.722 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 20' ' ' GLU . 4.7 m -117.4 119.93 33.91 Favored Pre-proline 0 C--N 1.33 -0.26 0 C-N-CA 121.214 -0.194 . . . . 0.0 111.385 178.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.476 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 72.6 Cg_endo -74.84 41.63 0.75 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.356 2.038 . . . . 0.0 111.6 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.471 ' O ' HG12 ' A' ' 56' ' ' VAL . 80.2 p -71.07 89.93 0.83 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.586 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -66.44 -13.23 60.48 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.589 -0.445 . . . . 0.0 110.166 178.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.6 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.5 m-85 -64.11 -12.96 44.29 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.564 HG23 ' HA ' ' A' ' 9' ' ' ALA . 9.4 p -114.6 140.9 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 121.129 0.49 . . . . 0.0 110.848 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -133.78 163.25 29.89 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.418 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.754 ' HA ' HG12 ' A' ' 7' ' ' VAL . 71.6 ttt-85 -80.21 135.74 36.33 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.47 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.684 179.786 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mtp . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.876 0.37 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.2 p -78.6 148.44 33.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.979 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -91.7 -4.5 55.03 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.687 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -98.76 139.14 34.9 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 121.001 0.429 . . . . 0.0 111.308 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.463 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.7 t -117.25 129.93 72.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.402 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -98.67 112.32 30.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.352 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.762 HG12 ' CA ' ' A' ' 58' ' ' ARG . 35.4 m -131.58 162.28 39.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.045 0.45 . . . . 0.0 111.835 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.59 ' C ' HG23 ' A' ' 56' ' ' VAL . 33.5 mt -120.18 124.58 72.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.851 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.613 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.61 120.43 20.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.061 0.458 . . . . 0.0 111.481 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -92.96 -9.49 39.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.842 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.645 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.3 m-90 -141.86 142.24 33.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.87 0.366 . . . . 0.0 110.85 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -72.43 123.15 22.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.462 -179.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.445 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 57.8 t80 -127.53 137.77 52.72 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.53 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.01 135.13 41.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.941 ' HB1' ' HG3' ' A' ' 20' ' ' GLU . . . -61.91 136.84 58.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.032 0.444 . . . . 0.0 111.795 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -86.53 0.14 54.91 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.313 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.474 ' HB2' ' HG2' ' A' ' 20' ' ' GLU . 96.7 mt-30 -153.69 162.0 41.64 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.914 0.387 . . . . 0.0 110.992 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -64.75 -40.21 94.93 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.242 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -61.01 -31.3 70.92 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.918 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.941 ' HG3' ' HB1' ' A' ' 15' ' ' ALA . 6.1 pt-20 -86.47 175.5 8.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.12 -179.417 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.714 ' O ' HG11 ' A' ' 51' ' ' VAL . 10.6 mp -128.88 158.88 37.52 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -176.187 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -86.97 149.67 24.61 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.884 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.611 HG22 HD11 ' A' ' 29' ' ' LEU . 47.6 pt -130.68 161.05 41.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.798 178.43 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 64.6 mttm -115.9 166.54 11.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.253 0.549 . . . . 0.0 111.437 -179.423 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 54.9 pttt -66.37 -11.24 50.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.781 -179.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -140.54 25.35 2.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.406 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 82.3 tt0 -100.94 140.0 35.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.101 0.477 . . . . 0.0 110.69 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 -91.69 119.57 31.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.824 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.636 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.2 mm? -110.55 143.59 40.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.419 -178.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 29.4 m-90 -98.78 106.01 18.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.985 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.463 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 73.0 mt -75.64 148.77 38.48 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.489 0.662 . . . . 0.0 111.823 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.596 HD23 ' HA ' ' A' ' 41' ' ' VAL . 3.6 mm? -115.27 -35.52 4.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.896 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -160.68 116.96 2.31 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.753 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.444 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -109.99 3.81 20.79 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.0 t -66.63 -39.24 88.19 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.799 0.333 . . . . 0.0 111.289 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -82.66 159.15 22.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.641 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.0 -34.75 68.46 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 121.417 0.627 . . . . 0.0 109.38 178.437 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.467 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 63.4 m95 -96.18 130.03 43.34 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.458 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 39.6 m0 -104.4 127.3 52.06 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.44 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 66.8 ttt180 -84.9 126.88 33.86 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.636 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -134.69 161.92 39.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.102 0.477 . . . . 0.0 111.87 -178.671 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.413 ' CB ' HG22 ' A' ' 48' ' ' THR . 41.6 ttm180 -123.66 151.31 43.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.891 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.401 ' OD1' HD13 ' A' ' 29' ' ' LEU . 34.0 m-20 -119.68 168.57 10.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.813 0.34 . . . . 0.0 111.246 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.19 67.73 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.382 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.86 4.56 9.52 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.1 t30 72.44 24.06 3.02 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.819 0.343 . . . . 0.0 111.093 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.48 ' CB ' HD21 ' A' ' 21' ' ' LEU . 81.2 mtp180 -106.09 135.5 47.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.413 HG22 ' CB ' ' A' ' 42' ' ' ARG . 77.0 p -124.66 157.58 35.21 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.21 -179.398 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.687 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -174.02 174.27 46.25 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 120.303 -0.951 . . . . 0.0 113.105 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.458 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 84.7 m-85 -107.2 97.0 6.82 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -178.54 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.815 HG13 ' HB2' ' A' ' 20' ' ' GLU . 0.8 OUTLIER -115.26 116.91 41.66 Favored Pre-proline 0 N--CA 1.469 0.51 0 CA-C-O 119.622 -0.228 . . . . 0.0 111.361 177.839 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.467 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 73.9 Cg_endo -76.63 44.4 1.4 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.243 1.962 . . . . 0.0 111.464 177.396 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.52 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.8 OUTLIER -70.26 80.08 0.53 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -59.49 -17.28 30.37 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.554 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.645 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 85.7 m-85 -59.82 -12.51 7.57 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.613 HG23 ' HA ' ' A' ' 9' ' ' ALA . 8.6 p -109.6 143.73 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 120.939 0.399 . . . . 0.0 110.96 179.527 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 55.6 mp0 -143.38 161.22 38.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.583 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.762 ' CA ' HG12 ' A' ' 7' ' ' VAL . 77.8 ttt180 -71.01 140.51 50.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.125 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.4 tttt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.753 179.312 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mtm . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.734 0.302 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.3 p -75.64 155.92 35.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.948 0.404 . . . . 0.0 111.124 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -97.75 119.34 36.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.915 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -102.75 139.23 38.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.407 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 30' ' ' TRP . 93.2 t -115.61 133.25 62.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.184 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.423 HG12 ' CD1' ' A' ' 30' ' ' TRP . 41.5 mt -114.49 115.88 50.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.771 0.32 . . . . 0.0 110.847 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.669 HG12 ' CA ' ' A' ' 58' ' ' ARG . 34.9 m -130.77 159.68 42.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.129 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.625 HD12 ' HG2' ' A' ' 28' ' ' ARG . 16.4 mm -114.93 125.71 72.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.59 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.526 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.05 145.17 42.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.802 0.334 . . . . 0.0 110.862 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -112.75 -23.7 10.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.477 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.58 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.8 m-90 -134.21 139.76 46.02 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.975 0.417 . . . . 0.0 110.593 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -66.68 121.22 14.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.282 -178.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.442 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 47.3 t80 -126.25 136.56 52.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.694 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.5 m -103.34 145.56 29.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.841 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.773 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.28 138.92 54.18 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.276 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -84.54 -9.3 58.45 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.975 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.438 ' HB2' ' HG2' ' A' ' 20' ' ' GLU . 74.9 mt-30 -150.75 168.78 23.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.235 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -67.08 -34.0 76.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.893 0.378 . . . . 0.0 111.64 -179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -77.66 -6.03 52.45 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.019 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.773 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -87.74 179.04 6.57 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.801 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.959 HD23 HG13 ' A' ' 41' ' ' VAL . 43.7 tp -121.32 119.12 31.27 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.107 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -68.32 141.47 55.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.266 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.472 HG22 HD11 ' A' ' 29' ' ' LEU . 14.9 pt -128.14 165.52 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.981 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 60.2 mttt -114.09 -179.12 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.215 0.531 . . . . 0.0 111.057 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.429 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 36.5 ttpt -64.53 -48.14 76.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.804 -178.823 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -113.09 2.57 15.74 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.482 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 71.3 tt0 -60.53 148.19 38.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.122 0.487 . . . . 0.0 111.363 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.625 ' HG2' HD12 ' A' ' 8' ' ' ILE . 84.6 mtm180 -94.54 121.32 35.96 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.946 179.46 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.673 ' HB3' HG21 ' A' ' 41' ' ' VAL . 3.6 mm? -114.58 137.79 51.45 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.454 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.489 ' C ' HG23 ' A' ' 41' ' ' VAL . 6.3 m0 -101.3 106.01 17.15 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.982 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.446 HD11 ' CZ3' ' A' ' 39' ' ' TRP . 81.3 mt -78.58 154.53 30.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.488 0.661 . . . . 0.0 111.94 -179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.0 mp -117.09 -29.19 6.01 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.808 179.227 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -158.98 116.65 2.82 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.203 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.489 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 40.2 p-10 -111.14 10.45 21.91 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.5 t -74.2 -35.24 63.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.878 0.371 . . . . 0.0 111.432 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmtp -84.4 159.62 20.79 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.794 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 87.9 m -59.27 -32.97 70.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.422 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.451 ' CD1' ' N ' ' A' ' 38' ' ' TRP . 2.8 m95 -96.74 130.95 43.89 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.489 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 32.5 m0 -103.36 135.85 44.22 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -177.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.442 ' HG2' HD13 ' A' ' 32' ' ' LEU . 28.3 ttm180 -96.7 127.86 43.09 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.959 HG13 HD23 ' A' ' 21' ' ' LEU . 3.8 p -143.55 156.62 16.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.962 -177.422 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -122.84 143.18 50.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.049 0.452 . . . . 0.0 111.68 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.548 ' CG ' HD21 ' A' ' 21' ' ' LEU . 43.0 m-20 -107.37 161.67 14.6 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.236 179.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.98 -24.28 64.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.197 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.67 2.64 11.46 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.357 -0.383 . . . . 0.0 112.032 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.2 t30 73.93 24.38 2.07 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.678 0.275 . . . . 0.0 111.042 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -109.39 129.71 55.53 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.308 -0.406 . . . . 0.0 109.956 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.1 p -125.15 161.58 26.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.694 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 178.6 169.73 39.71 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.997 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -97.49 108.76 21.54 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.788 0.328 . . . . 0.0 111.689 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.559 HG13 ' HB3' ' A' ' 20' ' ' GLU . 9.6 m -132.3 114.17 14.69 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.64 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -70.77 44.5 0.51 Allowed 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 121.858 1.706 . . . . 0.0 111.761 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.525 ' O ' HG12 ' A' ' 56' ' ' VAL . 85.6 p -70.57 76.91 0.58 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 121.045 0.45 . . . . 0.0 110.506 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -60.14 -17.97 44.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.638 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.58 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 83.0 m-85 -58.86 -15.5 12.87 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.593 HG23 ' C ' ' A' ' 8' ' ' ILE . 4.5 p -112.95 141.12 29.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-O 121.001 0.429 . . . . 0.0 110.676 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -142.96 162.57 35.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.088 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.669 ' CA ' HG12 ' A' ' 7' ' ' VAL . 29.5 ttm180 -70.96 140.59 50.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.772 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.965 -179.907 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.5 mtp . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.887 0.375 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.5 t -100.01 135.99 40.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.184 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -95.75 139.49 31.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.874 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -84.7 132.22 34.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.179 0.514 . . . . 0.0 110.995 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.4 t -117.69 128.21 74.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.041 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.4 mt -104.15 112.97 39.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.438 0.161 . . . . 0.0 111.312 -179.805 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.695 HG12 ' CA ' ' A' ' 58' ' ' ARG . 32.1 m -128.15 162.72 33.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 120.794 0.331 . . . . 0.0 111.469 179.315 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.725 HD12 ' HG2' ' A' ' 28' ' ' ARG . 19.3 mm -120.01 120.07 62.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.586 -179.382 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.429 ' N ' HG23 ' A' ' 56' ' ' VAL . . . -76.4 119.65 20.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.745 179.664 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -92.48 -8.37 44.79 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.037 -179.759 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.444 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 7.3 m-90 -142.49 142.4 32.27 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.789 0.328 . . . . 0.0 110.859 -179.594 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -71.56 122.59 20.76 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.046 0.45 . . . . 0.0 110.95 -178.916 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.45 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 58.4 t80 -127.8 137.08 52.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.943 -179.908 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.6 m -103.77 139.06 39.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.653 179.599 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.71 136.73 50.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.575 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -91.18 1.51 57.04 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.441 178.776 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.514 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 99.3 mt-30 -142.74 166.23 25.23 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.219 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -75.82 -20.9 57.81 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.136 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -90.16 -5.51 56.37 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -179.486 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.558 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -87.25 -179.46 6.42 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.051 0.453 . . . . 0.0 111.499 -179.565 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.957 HD21 ' HB2' ' A' ' 43' ' ' ASN . 14.2 tp -124.1 130.67 52.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.526 -178.069 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -72.82 147.54 45.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.467 179.303 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.558 HG22 HD11 ' A' ' 29' ' ' LEU . 37.2 pt -132.2 164.3 35.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.647 179.503 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 59.9 mttt -118.06 167.09 11.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.158 0.504 . . . . 0.0 110.975 179.808 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 52.6 pttt -66.45 -11.52 52.41 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.931 -179.575 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -141.78 27.73 1.82 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.965 0.412 . . . . 0.0 110.903 179.542 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.511 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 82.0 tt0 -99.69 140.7 33.5 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.208 0.528 . . . . 0.0 111.04 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.725 ' HG2' HD12 ' A' ' 8' ' ' ILE . 76.2 mtm180 -89.16 119.28 29.52 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.712 -179.928 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.733 ' HB3' HG21 ' A' ' 41' ' ' VAL . 3.0 mm? -115.23 139.9 49.55 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.806 -178.165 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.56 ' C ' HG23 ' A' ' 41' ' ' VAL . 5.5 m-90 -103.83 104.42 14.42 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.308 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.468 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 33.6 mt -77.56 142.22 39.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.259 0.552 . . . . 0.0 112.05 -178.932 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -105.02 -26.7 12.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.04 -179.899 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -159.03 115.12 2.62 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.803 0.335 . . . . 0.0 110.788 179.739 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.422 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 88.6 m-20 -108.18 4.67 25.06 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.061 -179.746 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.4 p -71.19 -34.32 70.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.967 0.413 . . . . 0.0 111.026 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -83.78 158.14 21.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.716 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 81.3 m -59.32 -33.04 70.64 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.195 178.285 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.447 ' N ' ' CD1' ' A' ' 38' ' ' TRP . 5.5 m95 -98.74 131.7 44.68 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 177.554 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 35.9 m0 -103.87 130.94 51.5 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -177.404 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.447 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 39.6 ttt85 -88.09 136.4 32.99 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 177.601 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.733 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.4 p -150.36 155.17 7.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.831 -178.879 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.508 ' HG3' HG22 ' A' ' 48' ' ' THR . 48.4 ttp180 -121.4 144.2 48.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.075 -179.709 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.957 ' HB2' HD21 ' A' ' 21' ' ' LEU . 43.8 t-20 -110.41 164.45 12.68 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.062 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.13 -25.4 65.45 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.256 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.26 3.72 8.36 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 179.382 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 73.96 24.36 2.06 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 120.749 0.309 . . . . 0.0 110.819 -179.621 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.4 mtm180 -108.05 131.56 54.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.069 179.52 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.508 HG22 ' HG3' ' A' ' 42' ' ' ARG . 30.6 p -126.34 147.86 49.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.144 -179.472 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.458 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.22 167.3 39.77 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.806 179.861 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.447 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.2 m-85 -99.63 106.44 18.39 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 117.082 0.441 . . . . 0.0 112.182 -179.23 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.525 HG13 ' HB3' ' A' ' 20' ' ' GLU . 14.0 m -124.94 114.47 26.54 Favored Pre-proline 0 CA--C 1.534 0.342 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 179.19 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.98 35.4 0.27 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 122.027 1.818 . . . . 0.0 112.211 177.698 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.472 ' O ' HG12 ' A' ' 56' ' ' VAL . 7.5 t -67.93 81.46 0.21 Allowed 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 120.861 0.362 . . . . 0.0 110.426 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -57.11 -19.12 17.9 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.146 0.498 . . . . 0.0 110.626 178.375 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.434 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 91.8 m-85 -54.58 -16.52 2.47 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.728 179.447 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.599 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.6 p -115.69 140.49 37.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 120.958 0.408 . . . . 0.0 111.147 179.826 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -145.54 161.91 38.67 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.891 -179.909 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.695 ' CA ' HG12 ' A' ' 7' ' ' VAL . 67.5 ttp85 -72.48 142.15 48.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.902 179.805 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 94.3 mttt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.671 179.443 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.6 mmm . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.85 0.357 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.6 t -96.88 131.6 43.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -99.17 119.2 37.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.872 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -98.99 137.38 37.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.1 0.476 . . . . 0.0 111.114 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.506 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 60.4 t -112.28 129.82 67.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.733 179.82 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.473 HG12 ' HD1' ' A' ' 30' ' ' TRP . 24.6 mt -102.6 120.61 52.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.08 -179.98 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.676 HG12 ' HB3' ' A' ' 58' ' ' ARG . 27.2 m -129.62 164.98 30.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.164 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.625 ' C ' HG23 ' A' ' 56' ' ' VAL . 26.2 mt -123.14 123.8 68.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.687 179.545 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.483 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.9 120.51 21.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.346 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -90.04 -7.21 54.45 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.814 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.548 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 5.3 m-90 -144.48 143.25 30.78 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.819 0.343 . . . . 0.0 111.342 -179.604 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -70.45 121.58 18.03 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.548 179.952 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.47 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 63.6 t80 -127.66 140.13 52.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.966 0.412 . . . . 0.0 111.397 -179.476 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 75.0 m -102.21 137.97 39.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.683 179.674 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.583 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.8 139.23 54.5 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.488 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -89.93 -0.01 57.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.299 179.1 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.496 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 94.2 mt-30 -147.23 163.85 35.05 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 179.225 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -70.59 -24.72 62.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 111.814 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -82.91 -15.51 51.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.271 -0.422 . . . . 0.0 112.115 -179.142 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.583 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -85.88 177.53 7.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.097 0.475 . . . . 0.0 110.431 179.749 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.654 ' O ' HG21 ' A' ' 51' ' ' VAL . 8.2 mp -129.43 142.41 50.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.489 -179.471 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -77.92 155.67 30.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.803 179.914 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.47 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 50.6 pt -133.55 165.02 33.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.478 179.59 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 40.0 mttp -115.76 165.73 12.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.062 0.458 . . . . 0.0 111.146 -179.652 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.548 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 22.4 pttp -64.97 -14.14 59.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.629 -179.328 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -138.92 25.72 2.51 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.189 179.738 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 80.8 tt0 -100.77 138.54 37.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.104 0.478 . . . . 0.0 110.967 -179.95 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.519 ' C ' HD22 ' A' ' 29' ' ' LEU . 82.6 mtm180 -94.1 123.17 37.3 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.927 -179.853 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.692 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -115.72 150.2 37.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.889 0.376 . . . . 0.0 111.1 -179.668 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.473 ' HD1' HG12 ' A' ' 6' ' ' ILE . 7.5 m-90 -101.38 111.73 24.04 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.267 179.917 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.506 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 72.0 mt -74.84 148.56 40.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.945 0.402 . . . . 0.0 111.416 -179.794 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.4 mp -111.31 -27.22 8.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.67 179.454 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -161.87 118.38 2.09 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.595 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.457 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 35.0 p-10 -110.02 6.76 23.29 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.655 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.0 p -71.87 -35.5 69.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.957 0.408 . . . . 0.0 111.212 -179.715 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -83.63 157.56 22.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.715 -179.491 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.8 m -57.32 -35.52 69.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.199 178.315 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -97.5 128.54 44.34 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.6 177.854 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.457 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 42.2 m0 -99.03 140.23 33.5 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -177.903 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.545 ' HG2' HD13 ' A' ' 32' ' ' LEU . 47.8 ttt180 -99.56 134.47 42.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.075 -0.966 . . . . 0.0 108.778 178.081 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.692 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.5 OUTLIER -136.53 161.92 36.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.924 0.392 . . . . 0.0 111.8 -178.455 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.463 ' HB2' HG22 ' A' ' 48' ' ' THR . 37.9 ttp-105 -126.5 143.06 51.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.091 179.658 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.537 ' ND2' ' HB3' ' A' ' 45' ' ' ALA . 44.4 p-10 -110.81 169.39 8.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.55 -179.452 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.85 -22.57 64.36 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.355 179.827 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.537 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . . . -73.73 5.79 3.72 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.793 179.214 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 67.58 22.65 9.09 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 121.015 0.436 . . . . 0.0 110.957 -179.264 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -109.43 137.97 46.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.306 179.335 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.463 HG22 ' HB2' ' A' ' 42' ' ' ARG . 52.2 p -121.52 161.56 22.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.752 0.311 . . . . 0.0 110.988 -179.803 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.33 174.77 47.24 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.692 -179.876 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.532 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 95.6 m-85 -107.7 111.23 23.33 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.783 0.325 . . . . 0.0 111.386 -179.684 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.654 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.5 t -122.41 109.54 32.89 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.189 179.609 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.05 32.64 0.27 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.214 1.943 . . . . 0.0 112.313 178.876 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.541 ' HB2' HG12 ' A' ' 51' ' ' VAL . 8.8 t -72.93 87.01 1.31 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 120.948 0.404 . . . . 0.0 111.065 -179.675 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -67.14 -8.66 32.67 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.757 178.649 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -63.34 -10.08 14.86 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.856 179.418 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.625 HG23 ' C ' ' A' ' 8' ' ' ILE . 5.6 p -118.05 142.11 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-O 120.895 0.378 . . . . 0.0 110.801 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.412 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 84.8 tt0 -147.04 159.56 43.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.824 -179.712 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.676 ' HB3' HG12 ' A' ' 7' ' ' VAL . 29.4 ptt180 -71.43 144.44 49.75 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.798 0.332 . . . . 0.0 111.18 179.836 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.9 tttt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.19 -0.909 . . . . 0.0 110.716 179.341 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.8 ttp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.841 0.353 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 64.5 p -77.95 153.2 32.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.978 179.963 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -90.58 -6.97 54.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.664 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -70.69 141.42 51.6 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.068 0.461 . . . . 0.0 110.963 179.819 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.477 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 58.4 t -112.61 130.82 65.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.442 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.1 mt -115.35 119.28 61.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.167 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.733 HG12 ' HA ' ' A' ' 58' ' ' ARG . 28.0 m -132.16 161.13 41.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.08 179.477 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 28.0 mm -116.55 127.85 74.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.435 179.534 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.23 148.18 39.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -179.669 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 63.6 mttp -113.6 -16.83 12.29 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.671 179.951 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.532 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 16.1 m-90 -142.42 137.97 30.75 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.102 0.477 . . . . 0.0 110.655 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -63.62 123.74 19.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.035 -178.863 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.49 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 55.5 t80 -127.89 139.55 52.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.63 -179.613 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.15 138.62 40.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.191 179.212 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.74 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.27 127.42 29.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.445 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.41 ' OE1' ' CZ3' ' A' ' 38' ' ' TRP . 96.0 mt-30 -62.36 -35.02 77.82 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.148 0.499 . . . . 0.0 110.367 179.678 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -129.3 162.0 28.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.097 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -61.89 -34.66 76.44 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.014 0.435 . . . . 0.0 111.157 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -63.11 -24.75 68.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.444 -179.823 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.74 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.3 mm-40 -81.04 -179.58 7.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.117 0.485 . . . . 0.0 110.131 179.621 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.76 HD21 ' HB3' ' A' ' 43' ' ' ASN . 6.9 tp -119.42 144.58 46.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.517 -178.524 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -85.31 143.57 28.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.761 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.497 HD11 ' OG ' ' A' ' 53' ' ' SER . 38.8 pt -131.0 162.92 38.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.651 179.539 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 72.0 mmtt -110.97 176.2 5.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.163 0.506 . . . . 0.0 111.064 179.691 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.517 ' HG3' ' HA ' ' A' ' 11' ' ' TRP . 28.6 ttpp -63.08 -45.91 89.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.841 -178.827 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -109.76 -0.25 18.55 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.505 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 78.5 tt0 -64.63 145.3 56.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.423 0.63 . . . . 0.0 111.19 -179.405 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.448 ' C ' HD22 ' A' ' 29' ' ' LEU . 22.4 ptt-85 -99.26 121.96 41.77 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.533 -179.992 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.738 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.0 mm? -113.38 146.55 39.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.555 -179.099 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.411 ' C ' HG23 ' A' ' 41' ' ' VAL . 4.4 m-90 -102.11 108.35 19.73 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.268 179.804 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.477 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 83.8 mt -75.04 150.75 38.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.033 0.444 . . . . 0.0 111.638 -179.517 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -112.63 -28.43 7.82 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.664 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -160.99 118.47 2.36 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.853 0.359 . . . . 0.0 110.768 179.763 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.484 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 32.7 p-10 -106.84 1.23 24.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.282 -179.765 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.4 m -63.9 -37.36 87.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.889 0.376 . . . . 0.0 111.687 -179.435 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -81.91 158.67 23.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.148 -179.133 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.7 m -58.96 -37.01 75.78 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 177.919 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.41 ' CZ3' ' OE1' ' A' ' 16' ' ' GLN . 26.7 m95 -96.37 129.35 43.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.51 177.697 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.484 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 36.2 m0 -99.21 138.78 35.82 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.825 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.448 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 69.7 ttt180 -97.04 132.77 42.51 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.188 178.378 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.738 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.1 p -140.83 155.91 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.143 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.554 ' HG3' HG22 ' A' ' 48' ' ' THR . 37.4 ttm180 -125.23 140.16 53.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.69 -179.282 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.76 ' HB3' HD21 ' A' ' 21' ' ' LEU . 47.6 p-10 -108.92 172.13 7.03 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.174 0.512 . . . . 0.0 111.749 179.687 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.2 -24.34 67.16 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.168 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.598 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -73.36 3.47 5.88 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 179.472 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.6 t30 69.57 24.96 5.42 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 120.861 0.362 . . . . 0.0 111.28 -179.89 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.598 ' NH1' ' HB1' ' A' ' 45' ' ' ALA . 81.5 mtt85 -112.98 136.07 53.06 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.087 179.133 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.554 HG22 ' HG3' ' A' ' 42' ' ' ARG . 31.4 p -125.0 156.76 37.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.042 0.449 . . . . 0.0 111.704 -179.026 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -173.26 173.16 45.61 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.458 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.448 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.7 m-85 -102.66 110.12 21.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.882 0.372 . . . . 0.0 110.462 179.836 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.533 HG21 ' O ' ' A' ' 21' ' ' LEU . 13.1 t -121.98 110.14 33.27 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.658 -179.737 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -73.99 35.87 0.39 Allowed 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 121.824 1.682 . . . . 0.0 112.46 177.959 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.576 ' O ' HG12 ' A' ' 56' ' ' VAL . 23.1 t -68.54 87.52 0.32 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.826 0.345 . . . . 0.0 111.074 -179.44 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -59.83 -18.33 43.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.188 0.518 . . . . 0.0 110.062 177.54 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.532 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.9 m-85 -56.0 -17.05 5.78 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.657 179.589 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.576 HG12 ' O ' ' A' ' 53' ' ' SER . 7.1 p -113.07 142.98 23.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 CA-C-O 121.047 0.451 . . . . 0.0 110.86 -179.821 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.409 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 86.2 tt0 -141.86 159.94 41.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.766 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.733 ' HA ' HG12 ' A' ' 7' ' ' VAL . 78.8 mtp180 -69.59 141.62 53.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.835 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.721 179.58 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.0 ttm . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 120.83 0.348 . . . . 0.0 111.376 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 60.3 p -97.89 129.74 44.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.017 0.437 . . . . 0.0 111.041 179.723 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -100.97 127.62 47.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.759 179.678 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -71.47 144.43 49.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.012 0.434 . . . . 0.0 110.846 179.889 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.48 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.8 t -110.21 128.65 66.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.42 179.836 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.6 mm -98.42 117.38 43.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.994 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.806 HG12 ' CA ' ' A' ' 58' ' ' ARG . 34.1 m -135.12 162.3 38.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.145 0.498 . . . . 0.0 112.05 -179.699 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.591 ' C ' HG23 ' A' ' 56' ' ' VAL . 15.4 mt -122.51 124.08 69.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.798 -179.464 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.614 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -76.59 119.94 21.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.073 0.463 . . . . 0.0 111.702 -179.491 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -91.56 -7.68 49.56 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.169 -179.769 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.72 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 15.9 m-90 -142.41 143.74 32.8 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.919 0.39 . . . . 0.0 110.536 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.7 p-10 -74.16 121.54 21.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.364 -179.13 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.447 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 60.9 t80 -127.91 138.22 52.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.67 179.914 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.3 t -101.41 142.57 32.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.768 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.776 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -58.03 132.42 53.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.836 -179.717 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.408 ' OE1' ' CH2' ' A' ' 38' ' ' TRP . 92.8 mt-30 -66.75 -30.38 70.58 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 121.131 0.491 . . . . 0.0 110.244 179.165 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -132.66 161.42 33.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.125 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -62.29 -31.95 72.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.895 0.379 . . . . 0.0 111.9 -179.163 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -71.17 -15.39 62.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.72 -179.744 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.776 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.4 mm-40 -84.79 -178.97 7.0 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.356 -179.388 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.883 HD21 ' HB2' ' A' ' 43' ' ' ASN . 13.1 tp -125.79 123.87 39.73 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -177.884 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -68.43 152.67 45.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.716 179.401 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.447 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 45.5 pt -133.98 162.13 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.098 179.249 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -117.11 164.84 14.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.285 0.564 . . . . 0.0 111.22 -179.934 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 52.0 pttt -64.54 -13.49 52.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.954 -179.591 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -140.72 24.77 2.21 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.331 179.643 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.556 ' HG2' HD22 ' A' ' 29' ' ' LEU . 80.5 tt0 -102.25 135.64 43.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.158 0.504 . . . . 0.0 110.871 179.845 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.487 ' HG2' HG23 ' A' ' 8' ' ' ILE . 87.0 mtm-85 -89.49 120.71 31.05 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.69 179.984 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.61 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.8 mm? -110.95 145.89 37.57 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.131 -177.792 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 27.1 m-90 -99.73 105.05 16.81 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.611 0.243 . . . . 0.0 111.216 179.173 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.48 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 96.1 mt -76.22 148.63 37.53 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.116 0.484 . . . . 0.0 111.2 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.559 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -112.77 -32.38 6.43 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.624 179.902 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -156.99 114.72 3.17 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.396 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.458 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 29.9 p-10 -109.27 1.79 20.4 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -179.035 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.4 m -65.02 -36.02 83.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.876 0.37 . . . . 0.0 111.584 -179.626 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -82.42 158.33 23.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.509 0.671 . . . . 0.0 112.488 -179.042 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 20.1 p -55.58 -39.42 70.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.354 178.112 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.408 ' CH2' ' OE1' ' A' ' 16' ' ' GLN . 28.8 m95 -93.26 133.28 36.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.759 -1.11 . . . . 0.0 108.285 177.24 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.458 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 33.9 m0 -105.48 131.35 53.01 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -177.871 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.465 ' HG2' HD13 ' A' ' 32' ' ' LEU . 29.6 ttp180 -91.06 133.11 35.58 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.753 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.61 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.7 p -143.61 159.72 16.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 C-N-CA 120.268 -0.573 . . . . 0.0 112.257 -177.554 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.727 ' HA ' HG22 ' A' ' 48' ' ' THR . 44.2 ttp180 -119.57 152.65 36.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.456 -179.08 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.883 ' HB2' HD21 ' A' ' 21' ' ' LEU . 58.4 t30 -120.46 159.73 24.55 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.749 0.309 . . . . 0.0 111.058 179.418 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.56 -21.34 52.47 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.849 178.765 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.424 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -80.45 5.7 14.37 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.171 179.19 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.8 m120 70.07 22.28 5.75 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 122.592 0.357 . . . . 0.0 111.311 -179.249 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.424 ' NH1' ' HB1' ' A' ' 45' ' ' ALA . 82.7 mtt85 -109.16 127.31 54.09 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.055 178.808 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.727 HG22 ' HA ' ' A' ' 42' ' ' ARG . 63.4 p -123.12 151.06 42.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.148 -179.61 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.439 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.57 174.9 40.63 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.561 179.856 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -105.16 110.88 23.43 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 117.0 0.4 . . . . 0.0 111.93 -179.436 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.56 HG13 ' HB3' ' A' ' 20' ' ' GLU . 16.0 m -132.46 115.45 14.85 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.12 178.661 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.35 43.58 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.773 1.649 . . . . 0.0 111.966 178.878 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.7 m -63.76 97.07 0.14 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.019 0.438 . . . . 0.0 110.462 -179.78 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -72.24 -15.67 61.93 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.498 179.093 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.72 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 89.2 m-85 -69.1 -10.47 57.79 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.452 -179.536 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.614 HG23 ' HA ' ' A' ' 9' ' ' ALA . 9.2 p -113.24 139.73 37.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 O-C-N 121.732 -0.605 . . . . 0.0 110.781 179.358 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -144.94 160.05 41.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.357 -179.81 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.806 ' CA ' HG12 ' A' ' 7' ' ' VAL . 36.9 ptt-85 -70.13 137.2 50.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.266 -179.475 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 61.9 tttm . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.744 179.81 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.8 mtp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.719 0.295 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.5 m -81.93 128.5 34.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.056 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -100.46 138.11 37.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.955 179.995 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -98.77 139.35 34.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.53 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 56.0 t -117.48 129.14 74.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.511 179.833 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.402 HG12 ' HD1' ' A' ' 30' ' ' TRP . 22.8 mt -104.73 121.01 56.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.825 179.816 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.677 HG12 ' HB3' ' A' ' 58' ' ' ARG . 25.5 m -132.72 161.07 42.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.97 0.414 . . . . 0.0 111.781 -179.798 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.705 ' C ' HG23 ' A' ' 56' ' ' VAL . 16.9 mt -120.99 128.05 76.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.005 -179.918 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -77.64 127.26 32.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.004 -179.988 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -93.74 -13.31 27.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.449 179.596 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.475 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 7.3 m-90 -140.58 154.12 46.37 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-O 120.999 0.428 . . . . 0.0 111.311 -179.699 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.473 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 11.4 t70 -76.58 123.82 26.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.525 -179.493 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.477 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 63.3 t80 -127.97 140.36 52.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.157 -179.776 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.1 m -104.19 138.02 41.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.703 179.571 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.61 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -59.0 138.03 57.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.784 -179.814 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -86.77 -0.27 56.06 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.455 178.703 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.531 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 78.1 mt-30 -147.75 167.42 24.73 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.135 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -73.67 -29.97 62.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.007 0.432 . . . . 0.0 111.361 -179.638 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -76.25 -14.94 60.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.208 -179.393 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.61 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -85.79 178.08 7.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.915 0.388 . . . . 0.0 111.04 -179.467 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.57 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.6 mp -124.85 141.64 51.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.3 0.572 . . . . 0.0 111.481 -178.19 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -80.77 147.78 30.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.746 179.615 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.477 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 47.0 pt -129.2 164.88 30.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.222 179.228 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 68.8 mttm -116.5 176.78 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.18 0.514 . . . . 0.0 112.037 -179.095 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.475 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 28.1 mttt -61.7 -30.17 70.57 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.838 -179.871 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -133.78 53.34 2.01 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.064 0.459 . . . . 0.0 110.903 -179.483 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.452 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 80.2 tt0 -117.08 137.69 52.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.038 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.53 ' HG2' HG12 ' A' ' 8' ' ' ILE . 94.0 mtm-85 -96.77 122.79 40.11 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.197 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.713 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -117.04 147.88 41.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.081 -179.873 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.402 ' HD1' HG12 ' A' ' 6' ' ' ILE . 5.2 m-90 -99.99 106.53 18.33 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.209 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.53 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 80.0 mt -76.24 146.39 39.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.094 0.473 . . . . 0.0 111.633 -179.401 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -111.69 -30.51 7.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.753 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -161.01 120.13 2.57 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.474 179.548 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.48 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.1 p-10 -110.84 1.54 17.74 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -179.46 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.7 m -63.41 -39.04 93.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.741 0.305 . . . . 0.0 111.532 -179.576 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -81.72 158.82 24.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.007 0.432 . . . . 0.0 111.656 -179.511 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.9 -35.01 68.49 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.077 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.602 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 61.2 m95 -96.92 129.38 44.38 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.453 177.668 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.495 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 39.4 m0 -104.17 132.71 50.14 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -177.662 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.572 ' HG2' HD13 ' A' ' 32' ' ' LEU . 65.5 ttt180 -87.92 134.12 33.78 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.592 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.713 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.2 p -139.73 161.22 27.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.761 -178.796 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.46 ' CB ' HG22 ' A' ' 48' ' ' THR . 42.9 ttm180 -125.54 142.01 51.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.837 -179.715 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -111.88 165.63 11.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.471 -179.523 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.69 -27.67 65.04 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.448 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -72.8 5.11 3.42 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.886 179.191 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.6 m120 69.23 25.68 5.61 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.002 0.43 . . . . 0.0 111.058 -179.659 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.548 ' O ' HD21 ' A' ' 21' ' ' LEU . 21.8 ttt180 -110.72 131.5 55.0 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.221 179.227 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.46 HG22 ' CB ' ' A' ' 42' ' ' ARG . 75.7 p -119.73 156.87 29.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.146 -179.818 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.46 177.7 44.94 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.103 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.567 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.0 m-85 -108.73 115.01 29.28 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.464 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.57 HG11 ' O ' ' A' ' 21' ' ' LEU . 12.6 m -128.59 110.32 19.06 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.601 179.407 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.602 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 57.9 Cg_endo -72.41 32.41 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.406 2.071 . . . . 0.0 112.218 178.481 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.462 ' O ' HG12 ' A' ' 56' ' ' VAL . 11.7 t -68.4 84.81 0.27 Allowed 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.471 -179.917 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -64.65 -11.3 33.92 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.866 178.743 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -62.93 -9.84 11.32 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 179.591 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.705 HG23 ' C ' ' A' ' 8' ' ' ILE . 6.2 p -117.91 139.1 46.37 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-O 121.022 0.439 . . . . 0.0 110.679 179.663 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -142.54 161.9 36.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.624 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.677 ' HB3' HG12 ' A' ' 7' ' ' VAL . 33.2 ptt-85 -71.14 141.12 50.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.875 0.369 . . . . 0.0 111.218 -179.803 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.6 tttt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.142 -0.932 . . . . 0.0 110.671 179.551 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.1 mtp . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 120.787 0.327 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.6 p -88.87 -3.83 58.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.485 179.812 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -98.83 137.17 37.8 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.972 0.415 . . . . 0.0 110.99 179.969 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -86.73 141.16 29.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.211 0.529 . . . . 0.0 111.14 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.416 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.0 t -109.31 130.97 61.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.553 179.805 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.2 mt -115.37 118.38 58.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.333 -179.647 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.722 HG12 ' HA ' ' A' ' 58' ' ' ARG . 29.1 m -132.14 160.21 42.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.941 0.4 . . . . 0.0 111.278 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.553 ' C ' HG23 ' A' ' 56' ' ' VAL . 35.3 mt -116.75 126.87 74.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.472 179.577 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.585 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.0 149.83 39.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.587 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -112.37 -20.65 11.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.183 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.514 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 16.4 m-90 -140.42 150.58 44.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.641 -179.944 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.48 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 50.9 t0 -72.97 124.57 25.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.346 -179.322 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 57.1 t80 -127.52 133.89 49.81 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.577 179.621 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.5 m -101.51 139.15 37.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.047 0.451 . . . . 0.0 111.104 -179.804 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.796 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.23 129.72 39.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.693 -179.905 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -65.53 -31.8 73.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.118 0.485 . . . . 0.0 110.008 179.345 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -130.99 163.81 26.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.114 179.623 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -64.61 -34.69 78.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.97 0.414 . . . . 0.0 111.266 -179.622 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.1 -19.39 65.96 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.444 -179.882 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.796 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 -82.63 -178.93 7.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.65 0.262 . . . . 0.0 111.175 -179.803 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.946 HD21 ' HB2' ' A' ' 43' ' ' ASN . 26.1 tp -120.79 134.44 55.29 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.161 0.505 . . . . 0.0 112.167 -178.326 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -78.86 145.64 34.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.15 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.48 HG22 HD11 ' A' ' 29' ' ' LEU . 31.3 pt -132.66 163.82 36.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.071 179.129 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 90.6 mttt -114.6 -176.74 2.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.232 0.539 . . . . 0.0 111.514 -179.545 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.48 ' HG2' ' HB2' ' A' ' 12' ' ' ASP . 63.6 mttt -63.37 -57.47 10.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.938 -179.494 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -100.02 -12.73 19.48 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.47 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 77.1 tt0 -51.83 143.15 13.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.886 0.374 . . . . 0.0 111.681 -178.989 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.547 ' C ' HD22 ' A' ' 29' ' ' LEU . 98.1 mtt180 -97.78 124.99 42.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.977 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.758 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.7 mm? -114.27 143.3 45.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.064 0.459 . . . . 0.0 111.695 -179.254 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.449 ' O ' HD22 ' A' ' 32' ' ' LEU . 4.0 m-90 -101.42 105.87 16.94 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.557 179.727 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.531 ' C ' HD22 ' A' ' 32' ' ' LEU . 79.3 mt -69.87 149.87 47.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.303 0.573 . . . . 0.0 111.936 -179.024 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.667 HD23 ' HA ' ' A' ' 41' ' ' VAL . 3.6 mm? -119.29 -31.88 4.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.797 -178.23 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -113.28 -83.74 0.6 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.114 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.514 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 18.2 m-20 72.01 3.84 4.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.899 -179.418 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.1 m -82.5 -36.04 26.82 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.886 0.374 . . . . 0.0 111.151 179.883 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -104.17 168.84 8.85 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.997 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 16.0 m -55.68 -30.31 60.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.673 178.494 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -97.56 126.97 43.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.854 178.253 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.514 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 42.5 m0 -106.88 134.22 50.35 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.582 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.483 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 58.4 ttp180 -92.24 127.21 37.63 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 177.475 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.758 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -135.1 161.73 39.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -178.293 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.458 ' HA ' HG22 ' A' ' 48' ' ' THR . 57.1 ttm-85 -123.25 139.9 53.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.713 -179.547 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.946 ' HB2' HD21 ' A' ' 21' ' ' LEU . 52.4 t30 -110.34 161.57 15.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.864 0.364 . . . . 0.0 111.274 179.878 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.25 -21.03 46.77 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.552 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.93 5.03 14.97 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.836 179.735 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 72.78 22.57 3.1 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.852 0.358 . . . . 0.0 111.001 -179.637 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.4 ' C ' HD13 ' A' ' 21' ' ' LEU . 99.7 mtt180 -107.23 132.44 53.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.158 179.242 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.458 HG22 ' HA ' ' A' ' 42' ' ' ARG . 73.2 p -127.27 151.0 49.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.696 0.284 . . . . 0.0 111.079 -179.592 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.497 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -170.5 172.84 44.27 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.577 -0.821 . . . . 0.0 113.115 -179.973 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.483 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 85.8 m-85 -101.52 114.04 27.7 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.641 0.258 . . . . 0.0 111.134 -179.905 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.518 HG13 ' HB3' ' A' ' 20' ' ' GLU . 15.7 m -136.05 114.15 10.77 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.737 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.24 43.21 0.84 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.164 1.909 . . . . 0.0 111.865 178.618 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.504 ' O ' HG12 ' A' ' 56' ' ' VAL . 88.6 p -71.07 90.3 0.85 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.001 0.429 . . . . 0.0 111.282 -179.383 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -66.21 -12.68 57.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.371 178.655 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.514 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.0 m-85 -62.63 -12.95 26.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.159 -179.995 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.585 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.2 p -115.35 141.18 33.3 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.099 0 CA-C-O 120.95 0.405 . . . . 0.0 110.695 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -137.94 164.73 28.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.331 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.722 ' HA ' HG12 ' A' ' 7' ' ' VAL . 17.1 mtp-105 -69.93 143.88 52.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.66 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.142 -0.932 . . . . 0.0 110.992 179.947 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.4 mtp . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.874 0.369 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 75.6 p -79.37 153.88 29.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.966 179.887 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -80.84 149.12 29.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.852 179.817 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -94.8 136.85 34.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.094 0.474 . . . . 0.0 111.164 -179.864 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.445 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.5 t -117.45 131.53 69.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.708 179.915 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.7 mt -113.87 116.06 51.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.98 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.661 HG12 ' HB3' ' A' ' 58' ' ' ARG . 23.0 m -132.23 161.1 41.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.837 0.351 . . . . 0.0 111.568 179.923 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.964 HD12 ' HD2' ' A' ' 59' ' ' LYS . 15.5 mt -119.0 123.0 70.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.288 -179.668 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.676 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.62 123.58 25.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.631 -179.718 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.472 ' HE3' ' HE2' ' A' ' 59' ' ' LYS . 38.8 mttp -93.7 -10.63 33.74 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.081 -179.955 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.787 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 11.1 m-90 -140.74 145.11 35.99 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.944 0.402 . . . . 0.0 110.839 179.841 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -72.81 122.21 21.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.083 -179.281 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.463 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 57.5 t80 -127.55 139.77 52.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.101 179.99 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 91.1 m -103.02 138.96 39.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.675 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.62 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -61.88 139.23 58.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.519 -179.667 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -87.83 -1.23 57.84 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.464 179.23 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.498 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 93.1 mt-30 -145.99 169.71 18.08 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 178.791 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -75.13 -33.36 61.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.106 0.479 . . . . 0.0 110.945 -179.645 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -71.43 -16.32 62.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.925 -179.635 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.62 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -86.56 178.73 6.98 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.022 -179.649 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.46 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.1 mp -129.59 139.04 51.57 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-O 121.098 0.475 . . . . 0.0 111.859 -177.754 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -74.72 148.55 40.41 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.852 179.324 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.447 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 41.8 pt -129.29 164.0 32.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.911 179.221 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.445 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 96.9 mttt -118.99 163.64 16.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.141 0.496 . . . . 0.0 111.141 -179.858 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.485 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 10.8 pttm -63.87 -10.53 21.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.52 -0.764 . . . . 0.0 113.029 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -140.68 26.4 2.11 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.013 179.494 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.454 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 82.4 tt0 -102.03 143.11 32.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.046 0.45 . . . . 0.0 110.705 179.899 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.495 ' C ' HD22 ' A' ' 29' ' ' LEU . 82.6 mtm-85 -95.33 119.41 33.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.291 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.673 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -116.12 145.21 43.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.128 -179.661 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -100.92 107.53 19.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.492 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.445 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 63.6 mt -77.9 149.66 34.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.119 0.485 . . . . 0.0 111.538 -179.583 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.498 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.8 mp -114.55 -29.84 6.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.039 179.795 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -157.05 115.0 3.19 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.883 0.373 . . . . 0.0 110.601 179.772 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.495 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 35.7 p-10 -106.28 2.34 26.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.229 -179.49 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 87.6 p -67.67 -37.63 82.62 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.904 0.383 . . . . 0.0 111.904 -179.351 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -81.61 162.08 23.24 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.328 0.585 . . . . 0.0 112.38 -179.044 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.491 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 17.1 p -57.55 -39.74 77.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.856 177.838 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.508 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 54.3 m95 -96.97 130.21 44.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.47 -1.241 . . . . 0.0 108.745 177.791 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.495 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 38.2 m0 -102.62 132.97 48.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -177.862 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.485 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 51.9 ttt180 -87.45 132.07 34.12 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 177.794 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.673 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -138.9 157.12 28.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.926 0.393 . . . . 0.0 111.81 -178.724 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.435 ' CB ' HG22 ' A' ' 48' ' ' THR . 43.4 ttm180 -119.49 142.97 47.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.988 -179.664 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -113.08 163.16 15.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.391 -179.502 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.23 -20.68 43.73 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.463 179.769 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.603 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -77.79 5.79 8.8 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 179.679 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.1 m120 68.48 26.92 6.43 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 120.948 0.404 . . . . 0.0 111.307 -179.903 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.603 ' NH1' ' HB1' ' A' ' 45' ' ' ALA . 83.3 mtt85 -115.05 144.5 43.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.55 178.719 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.435 HG22 ' CB ' ' A' ' 42' ' ' ARG . 75.5 p -129.74 153.91 47.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.568 0.223 . . . . 0.0 110.715 -179.867 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -169.02 176.12 43.24 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.552 -179.728 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.485 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 94.7 m-85 -108.13 114.6 28.62 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.217 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.55 HG13 ' HB3' ' A' ' 20' ' ' GLU . 6.0 m -133.16 111.22 12.98 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.812 179.255 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.508 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 13.7 Cg_exo -70.18 41.16 0.34 Allowed 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.734 2.29 . . . . 0.0 112.502 178.487 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.598 ' O ' HG12 ' A' ' 56' ' ' VAL . 6.7 p -69.03 74.19 0.3 Allowed 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 120.676 0.274 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -54.13 -17.51 2.82 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.146 -0.346 . . . . 0.0 111.223 178.708 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.787 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 91.1 m-85 -61.43 -8.06 3.71 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 179.26 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.676 HG23 ' HA ' ' A' ' 9' ' ' ALA . 9.2 p -111.2 140.15 31.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 O-C-N 121.386 -0.821 . . . . 0.0 110.727 179.808 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -136.55 150.57 48.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.224 179.803 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.661 ' HB3' HG12 ' A' ' 7' ' ' VAL . 33.6 ptt-85 -72.0 147.26 47.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.315 -179.465 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.964 ' HD2' HD12 ' A' ' 8' ' ' ILE . 98.5 mttt . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.306 -0.854 . . . . 0.0 110.82 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.5 ttm . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 80.5 p -80.25 147.73 31.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.1 -179.983 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -100.13 130.96 46.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.01 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -93.19 132.71 37.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.039 0.447 . . . . 0.0 111.212 -179.955 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 79.2 t -118.67 129.13 75.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.785 -179.9 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.5 mt -105.59 114.71 45.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.712 0.291 . . . . 0.0 111.751 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.722 HG12 ' HA ' ' A' ' 58' ' ' ARG . 30.8 m -132.98 159.46 43.17 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.741 0.305 . . . . 0.0 110.987 179.054 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.613 ' HB ' ' HD2' ' A' ' 59' ' ' LYS . 54.3 mt -121.5 124.28 71.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.062 0.458 . . . . 0.0 111.395 179.96 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.688 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.13 124.76 27.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.085 -179.989 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -93.08 -9.18 40.5 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.837 -179.992 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.813 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 14.3 m-90 -143.58 147.06 33.84 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.866 0.365 . . . . 0.0 110.473 179.431 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.3 p-10 -73.67 124.04 25.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.438 -178.719 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.46 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 46.3 t80 -128.64 135.09 48.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.511 179.173 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 66.8 m -100.36 139.88 35.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.267 0.556 . . . . 0.0 111.489 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.825 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.43 130.51 46.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.488 179.813 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -65.16 -28.21 69.25 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.015 0.436 . . . . 0.0 110.246 179.106 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -135.45 162.33 32.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.111 179.36 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -64.16 -29.91 71.0 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.904 0.383 . . . . 0.0 111.274 -179.705 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -69.48 -19.25 63.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.634 -179.757 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.825 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.3 mm-40 -82.55 -177.56 6.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.512 179.888 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.916 HD21 ' HB2' ' A' ' 43' ' ' ASN . 20.3 tp -123.7 133.14 53.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.138 0.494 . . . . 0.0 111.692 -178.913 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -77.65 148.56 34.97 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.806 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.472 HG22 ' HG ' ' A' ' 29' ' ' LEU . 36.6 pt -131.93 163.56 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.335 179.39 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 73.4 mmtt -118.38 164.2 15.6 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.144 0.497 . . . . 0.0 111.352 179.919 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.5 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 33.4 pttt -65.74 -11.11 42.91 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -179.671 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -140.6 23.34 2.3 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.168 179.638 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.472 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 78.6 tt0 -102.62 139.73 37.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.067 0.46 . . . . 0.0 110.695 179.939 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.58 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 11.9 ptp180 -95.25 121.38 36.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.212 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.658 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -113.58 152.69 29.96 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.517 -178.966 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.428 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 11.2 m-90 -103.36 105.57 15.87 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.501 -179.661 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.485 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 71.8 mt -77.63 146.34 36.19 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.076 0.465 . . . . 0.0 111.865 -179.335 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.569 HD13 ' HG2' ' A' ' 40' ' ' ARG . 4.9 mp -110.63 -29.53 7.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.203 179.976 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -158.96 116.74 2.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.865 0.364 . . . . 0.0 110.698 -179.672 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.485 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 42.6 p-10 -108.83 4.49 23.62 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.114 -179.381 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.7 m -68.32 -35.57 77.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.84 0.352 . . . . 0.0 111.383 -179.429 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -84.27 158.4 21.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.071 -179.162 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.476 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 19.3 p -55.36 -40.65 71.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.337 -0.847 . . . . 0.0 108.841 177.74 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.595 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 56.2 m95 -93.84 129.28 40.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.452 -1.249 . . . . 0.0 109.102 177.845 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.491 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 37.4 m0 -101.16 137.61 39.29 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.055 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.569 ' HG2' HD13 ' A' ' 32' ' ' LEU . 64.5 ttt180 -93.03 135.36 34.27 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 177.443 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.658 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -145.63 159.19 12.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.569 -178.935 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.633 ' HA ' HG22 ' A' ' 48' ' ' THR . 78.1 ttt180 -124.02 144.08 50.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.154 179.999 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.916 ' HB2' HD21 ' A' ' 21' ' ' LEU . 54.7 t30 -113.43 163.35 14.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.308 179.855 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.42 -24.7 63.7 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.662 -179.974 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.28 5.72 8.03 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.691 179.059 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 71.92 20.55 4.41 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.314 0.245 . . . . 0.0 111.08 -179.813 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -105.89 125.16 50.66 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.597 179.644 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.633 HG22 ' HA ' ' A' ' 42' ' ' ARG . 76.9 p -121.13 149.86 42.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.126 -179.732 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.62 176.74 40.43 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.639 179.719 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.491 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 85.7 m-85 -107.64 110.85 22.83 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.878 0.339 . . . . 0.0 111.579 -179.87 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.654 HG13 ' HB3' ' A' ' 20' ' ' GLU . 12.1 m -134.08 117.05 13.55 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 111.493 0.183 . . . . 0.0 111.493 179.515 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.595 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 57.6 Cg_endo -71.75 53.47 1.87 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.319 2.013 . . . . 0.0 111.613 179.111 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.646 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.8 m -66.92 92.99 0.25 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.093 -179.513 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.3 m120 -77.26 -10.4 59.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.902 0.382 . . . . 0.0 110.186 178.055 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.813 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 86.1 m-85 -81.37 6.24 15.03 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.323 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.688 HG23 ' HA ' ' A' ' 9' ' ' ALA . 13.2 p -118.08 144.66 25.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 O-C-N 121.946 -0.472 . . . . 0.0 110.51 179.591 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -128.09 156.82 42.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.824 -179.674 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.722 ' HA ' HG12 ' A' ' 7' ' ' VAL . 17.1 mtp-105 -73.43 142.44 46.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.793 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.613 ' HD2' ' HB ' ' A' ' 8' ' ' ILE . 56.3 mttm . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.876 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.1 mtm . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.4 m -80.51 138.85 36.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.811 0.339 . . . . 0.0 110.866 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -90.89 139.07 31.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.864 -179.955 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -99.59 138.28 36.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.092 0.472 . . . . 0.0 111.195 -179.856 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.428 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 58.6 t -111.92 130.16 66.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.32 179.716 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.44 HG12 ' CD1' ' A' ' 30' ' ' TRP . 50.3 mt -111.28 117.39 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.008 179.8 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.794 HG12 ' CA ' ' A' ' 58' ' ' ARG . 32.9 m -131.18 160.79 42.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.071 179.646 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.581 ' C ' HG23 ' A' ' 56' ' ' VAL . 16.8 mt -119.84 122.17 67.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.822 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.496 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -77.01 124.33 27.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.265 -179.925 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.456 ' CE ' ' HE2' ' A' ' 59' ' ' LYS . 94.8 mttt -92.97 -11.05 34.21 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.905 179.813 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.706 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 9.2 m-90 -140.42 146.51 38.4 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.744 0.307 . . . . 0.0 110.553 -179.762 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -75.57 124.08 26.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.238 0.542 . . . . 0.0 111.553 -178.371 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.493 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 59.0 t80 -128.05 136.48 51.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.623 179.683 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 59.6 m -103.82 139.99 38.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.815 179.777 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.581 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -58.06 137.09 57.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.891 -179.937 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -86.72 -3.77 59.09 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.234 178.486 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.452 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 81.5 mm-40 -143.07 162.64 34.97 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.857 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -71.93 -19.67 61.87 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.706 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -89.21 -10.67 46.16 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -179.506 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.581 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.1 mt-10 -83.33 179.54 7.66 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.036 0.446 . . . . 0.0 110.247 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.797 HD21 ' HB2' ' A' ' 43' ' ' ASN . 15.9 tp -122.84 128.49 50.45 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.914 -178.394 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -71.76 147.62 47.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.41 179.729 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.493 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 40.1 pt -132.23 161.87 40.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.761 179.461 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 99.0 mttt -117.67 163.09 16.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.073 0.464 . . . . 0.0 111.226 -179.87 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.472 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 55.4 pttt -64.18 -12.17 37.79 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -179.667 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -138.84 22.94 2.65 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.942 179.355 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.479 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 51.6 tp10 -100.12 140.93 33.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.105 0.478 . . . . 0.0 111.219 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.441 ' C ' HD22 ' A' ' 29' ' ' LEU . 61.2 mtt85 -91.94 122.43 34.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.704 -179.852 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.694 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.4 mm? -115.29 145.31 42.6 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.612 -178.386 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.44 ' CD1' HG12 ' A' ' 6' ' ' ILE . 6.3 m0 -101.65 107.63 18.94 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.547 179.648 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.437 ' HA ' HG23 ' A' ' 41' ' ' VAL . 92.9 mt -79.18 148.83 32.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.342 0.591 . . . . 0.0 112.146 -179.205 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.9 mp -112.06 -28.96 7.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.486 179.181 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -161.05 118.08 2.31 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.264 179.496 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.504 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.6 p-10 -113.22 11.76 18.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.111 -179.472 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.2 p -71.21 -37.87 72.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.913 0.387 . . . . 0.0 111.288 -179.678 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.07 160.95 20.84 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.411 0.624 . . . . 0.0 112.344 -179.269 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 36.5 p -55.3 -40.37 71.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.061 178.002 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.553 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 50.7 m95 -92.39 132.67 36.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.819 177.812 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.504 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -106.84 138.67 42.58 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.054 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.482 ' HG2' HD13 ' A' ' 32' ' ' LEU . 56.2 ttt180 -96.1 129.08 43.48 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.161 177.867 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.694 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.4 p -141.74 159.23 21.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -177.987 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.45 ' CB ' HG22 ' A' ' 48' ' ' THR . 71.3 ttt180 -124.07 141.87 51.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.289 -179.627 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.797 ' HB2' HD21 ' A' ' 21' ' ' LEU . 48.7 t30 -110.12 162.69 14.32 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 120.985 0.422 . . . . 0.0 111.021 179.281 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.01 -19.32 51.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.922 178.608 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.56 5.59 8.79 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.027 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 66.56 26.96 9.76 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.165 0.507 . . . . 0.0 111.105 -179.455 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.458 ' O ' HD13 ' A' ' 21' ' ' LEU . 57.3 ttm-85 -113.79 125.32 53.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.822 178.957 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.45 HG22 ' CB ' ' A' ' 42' ' ' ARG . 77.6 p -118.51 143.59 46.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.936 0.398 . . . . 0.0 111.554 -179.221 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.562 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -161.06 172.01 37.23 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.75 179.961 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.478 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 95.7 m-85 -104.71 107.87 19.04 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 117.019 0.409 . . . . 0.0 111.995 -179.432 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.517 HG11 ' O ' ' A' ' 21' ' ' LEU . 11.4 m -122.75 120.12 27.85 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.305 178.744 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.553 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 61.7 Cg_endo -73.54 31.59 0.32 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.39 2.06 . . . . 0.0 112.542 178.484 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 86.4 p -61.72 93.95 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 120.997 0.427 . . . . 0.0 111.178 -179.641 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -78.6 -4.85 50.93 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.593 178.321 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.706 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 86.1 m-85 -72.18 -9.77 58.89 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.405 179.22 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.581 HG23 ' C ' ' A' ' 8' ' ' ILE . 6.9 p -120.2 139.71 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 121.187 0.518 . . . . 0.0 110.614 -179.819 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -144.1 160.21 41.29 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.072 179.88 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.794 ' CA ' HG12 ' A' ' 7' ' ' VAL . 77.9 ttt-85 -69.4 138.57 53.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.928 0.394 . . . . 0.0 110.919 -179.688 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.55 ' HD2' HD12 ' A' ' 8' ' ' ILE . 95.2 mttt . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.839 -179.901 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.1 mtm . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.901 0.382 . . . . 0.0 111.371 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.5 p -79.14 152.37 30.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.945 0.402 . . . . 0.0 111.068 179.96 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -99.22 138.14 36.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.876 179.819 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -97.94 138.64 34.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.165 0.507 . . . . 0.0 111.194 -179.89 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.479 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.0 t -114.4 130.1 69.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.239 179.781 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.43 HG23 ' CD1' ' A' ' 30' ' ' TRP . 8.4 mt -109.88 117.02 53.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.388 -179.743 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.712 HG12 ' CA ' ' A' ' 58' ' ' ARG . 33.1 m -131.94 160.35 42.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.831 0.348 . . . . 0.0 111.157 179.466 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.678 HG23 ' HG2' ' A' ' 28' ' ' ARG . 21.4 mt -117.63 126.66 74.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.844 179.735 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.545 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.79 149.68 39.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.147 0.498 . . . . 0.0 110.867 -179.885 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -112.02 -21.43 11.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.948 179.87 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.503 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 20.3 m-90 -139.26 151.3 46.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.838 179.991 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.509 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 57.1 t0 -74.59 125.45 28.67 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.07 0.462 . . . . 0.0 111.196 -178.761 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.488 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 61.2 t80 -128.08 137.5 52.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.942 179.813 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.8 t -103.49 139.28 39.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.651 179.784 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.841 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.19 129.81 43.41 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.42 -179.935 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.416 ' HG2' ' OH ' ' A' ' 13' ' ' TYR . 95.2 mm-40 -62.85 -33.46 75.3 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.308 0.575 . . . . 0.0 110.186 179.471 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -131.39 161.67 31.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.205 179.739 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -62.03 -33.9 75.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.084 0.469 . . . . 0.0 111.288 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -65.87 -20.16 66.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.202 179.888 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.841 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.8 mm-40 -83.32 179.24 7.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 0.0 110.979 -179.663 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.826 HD21 ' HB3' ' A' ' 43' ' ' ASN . 39.8 tp -121.7 126.06 48.09 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.893 -178.547 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -73.18 159.07 34.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.804 179.314 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.488 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 41.5 pt -141.83 166.87 16.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.366 179.807 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.486 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 57.1 mttm -114.48 178.67 4.2 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.215 0.531 . . . . 0.0 111.524 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.509 ' HG2' ' HB2' ' A' ' 12' ' ' ASP . 20.6 mttp -61.49 -52.31 65.03 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.234 -179.543 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -107.13 -1.36 22.04 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -178.097 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.486 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 79.5 tt0 -62.89 144.43 56.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.233 0.539 . . . . 0.0 111.205 -179.541 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.678 ' HG2' HG23 ' A' ' 8' ' ' ILE . 75.5 mtp180 -100.36 120.82 40.53 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.313 -179.984 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.684 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.2 mm? -111.65 149.37 31.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.549 -178.758 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.462 ' C ' HG23 ' A' ' 41' ' ' VAL . 5.2 m-90 -103.91 107.73 18.75 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.126 179.709 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.479 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 88.0 mt -76.23 147.68 38.18 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.031 0.443 . . . . 0.0 111.996 -179.172 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.2 mp -109.8 -28.93 8.54 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.596 179.482 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -160.97 117.71 2.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.69 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.522 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.5 p-10 -110.53 3.04 19.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.132 -179.558 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.6 m -63.96 -38.4 90.93 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.772 0.32 . . . . 0.0 111.61 -179.735 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.69 162.76 19.57 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.331 0.586 . . . . 0.0 112.506 -179.075 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.456 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 19.6 p -58.94 -37.23 76.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.244 178.291 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.635 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 68.6 m95 -94.77 131.05 41.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.579 -1.191 . . . . 0.0 108.525 177.959 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.522 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -105.44 137.08 43.84 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.99 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.492 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 69.2 ttt180 -94.61 129.9 41.27 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.048 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.778 HG13 HD23 ' A' ' 21' ' ' LEU . 2.4 p -143.29 155.1 16.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 C-N-CA 120.382 -0.527 . . . . 0.0 112.155 -178.384 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.707 ' HG3' HG22 ' A' ' 48' ' ' THR . 28.4 ttp-105 -123.74 142.2 51.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.912 -179.613 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.826 ' HB3' HD21 ' A' ' 21' ' ' LEU . 43.6 p-10 -111.65 171.66 7.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.676 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.5 -26.72 68.69 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.381 -179.978 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.468 ' HB3' HD21 ' A' ' 43' ' ' ASN . . . -71.37 5.4 2.3 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 179.451 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 66.57 25.14 10.08 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.092 0.472 . . . . 0.0 111.026 -179.404 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -110.32 127.8 55.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.598 178.945 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.707 HG22 ' HG3' ' A' ' 42' ' ' ARG . 11.8 p -121.79 145.63 47.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.724 0.297 . . . . 0.0 110.878 -179.344 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.484 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.92 170.46 39.99 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.996 179.73 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.492 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 90.6 m-85 -101.56 112.45 25.01 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -179.436 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.585 HG13 ' HB3' ' A' ' 20' ' ' GLU . 15.8 m -135.22 116.09 12.05 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.59 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.635 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 63.2 Cg_endo -73.09 45.44 0.95 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.384 2.056 . . . . 0.0 111.903 179.044 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.536 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.6 p -70.21 85.22 0.56 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.792 -179.663 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -63.9 -14.6 54.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.008 0.432 . . . . 0.0 110.443 178.724 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.503 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 94.4 m-85 -61.32 -14.6 28.24 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.624 179.367 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.66 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.3 p -118.23 140.03 43.19 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 CA-C-O 121.182 0.515 . . . . 0.0 111.201 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -145.5 159.13 43.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.381 179.676 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.712 ' CA ' HG12 ' A' ' 7' ' ' VAL . 80.5 ttt180 -71.0 135.2 47.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.839 0.352 . . . . 0.0 110.842 179.912 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.054 179.656 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.449 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 79.9 t . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 120.79 0.329 . . . . 0.0 110.377 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 30.3 mm -98.49 114.58 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.16 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.466 HG21 HD11 ' A' ' 31' ' ' LEU . 22.4 m -132.25 165.66 31.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.969 0.414 . . . . 0.0 111.259 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.645 HG23 ' HG2' ' A' ' 28' ' ' ARG . 10.4 mt -128.84 129.02 68.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.51 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.702 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.93 141.14 45.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.605 -178.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -105.11 -20.18 13.6 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.746 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.585 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 18.4 m-90 -140.98 150.67 43.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.973 0.416 . . . . 0.0 110.027 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.8 p-10 -69.56 129.72 40.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.216 0.531 . . . . 0.0 112.072 -178.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.411 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 76.6 t80 -127.9 140.58 51.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.772 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.9 t -105.85 138.47 41.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.599 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.539 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -58.91 138.32 57.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.38 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -86.09 -3.26 58.91 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.364 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -146.17 170.15 17.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.708 0.29 . . . . 0.0 110.283 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -74.02 -27.29 60.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.497 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -80.56 -9.71 59.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.611 ' C ' HD12 ' A' ' 21' ' ' LEU . 0.5 OUTLIER -93.26 171.98 8.58 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.758 -179.889 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.611 HD12 ' C ' ' A' ' 20' ' ' GLU . 8.0 mp -120.19 134.88 55.15 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -74.62 147.0 42.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.424 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.698 HG22 HD11 ' A' ' 29' ' ' LEU . 46.0 pt -127.73 169.4 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.022 179.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -117.34 -176.74 3.07 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.158 0.504 . . . . 0.0 111.85 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -65.85 -37.55 86.5 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.786 -178.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -126.78 39.06 4.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.873 0.368 . . . . 0.0 111.409 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -100.37 132.41 45.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.645 ' HG2' HG23 ' A' ' 8' ' ' ILE . 50.9 mtm105 -88.08 125.7 34.71 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.451 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.698 HD11 HG22 ' A' ' 23' ' ' ILE . 1.1 mm? -116.07 150.31 37.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.824 -178.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 31.1 m-90 -102.62 105.82 16.38 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.442 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.611 HD23 HG23 ' A' ' 41' ' ' VAL . 88.4 mt -79.62 142.55 35.51 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.927 0.394 . . . . 0.0 112.028 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 41' ' ' VAL . 3.9 mp -111.3 -29.11 7.95 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.186 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -158.57 117.6 3.07 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.861 0.363 . . . . 0.0 111.251 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.44 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.4 p-10 -110.56 4.84 20.68 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.2 m -67.79 -36.22 80.05 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.815 0.341 . . . . 0.0 111.326 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -83.54 158.61 21.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.667 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 89.6 m -56.35 -35.22 67.38 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.332 178.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.9 m0 -99.15 133.05 43.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.44 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 42.2 m0 -104.39 134.68 47.19 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.422 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 53.4 ttt180 -86.62 133.08 33.73 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 178.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.632 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -137.78 161.49 33.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.02 0.438 . . . . 0.0 111.91 -177.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.429 ' CB ' HG22 ' A' ' 48' ' ' THR . 79.8 ttt180 -124.24 149.7 46.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.621 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.607 HD22 HD23 ' A' ' 21' ' ' LEU . 8.4 m-20 -121.81 160.72 24.05 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.08 0.466 . . . . 0.0 111.488 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.97 -19.83 13.98 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.6 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.99 5.35 11.91 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 72.56 22.74 3.23 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 122.527 0.331 . . . . 0.0 111.452 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.401 ' C ' HD21 ' A' ' 21' ' ' LEU . 95.5 mtt-85 -108.19 146.43 32.78 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.429 HG22 ' CB ' ' A' ' 42' ' ' ARG . 75.6 p -134.95 147.78 49.86 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.846 179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.26 174.72 43.7 Favored Glycine 0 C--N 1.339 0.733 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.29 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 89.4 m-85 -102.59 108.31 19.54 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.544 HG11 ' O ' ' A' ' 21' ' ' LEU . 22.3 m -127.32 115.87 21.52 Favored Pre-proline 0 CA--C 1.533 0.314 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.1 63.65 4.19 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 121.564 1.51 . . . . 0.0 110.968 178.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.713 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.0 OUTLIER -72.98 76.72 1.18 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.516 -178.825 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -60.45 -19.17 55.52 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.208 177.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.585 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 71.5 m-85 -86.91 44.21 1.15 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.004 -0.544 . . . . 0.0 112.122 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 53' ' ' SER . 11.9 p -136.36 146.77 28.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.838 0.352 . . . . 0.0 111.001 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -122.82 140.12 53.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.312 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -75.25 139.97 42.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.854 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.404 ' CE ' ' HB ' ' A' ' 8' ' ' ILE . 51.4 mtmt . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.855 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.7 t . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.96 0.409 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.1 mt -107.32 115.52 48.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.197 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.797 HG12 ' HA ' ' A' ' 58' ' ' ARG . 21.5 m -128.83 161.09 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 111.411 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.579 ' C ' HG23 ' A' ' 56' ' ' VAL . 16.2 mt -119.83 128.72 75.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.12 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.407 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -84.71 117.46 23.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.004 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -90.92 -3.71 57.1 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.515 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 15.9 m-90 -147.08 141.65 26.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.785 0.326 . . . . 0.0 110.377 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.2 p-10 -71.31 120.0 16.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.847 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.414 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 60.9 t80 -127.62 137.11 52.45 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.57 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.6 m -99.93 141.97 32.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.748 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.809 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.48 131.98 51.77 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.792 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -63.72 -30.94 71.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.118 0.485 . . . . 0.0 110.184 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -137.69 160.89 37.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.256 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -59.54 -35.07 73.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.935 0.398 . . . . 0.0 111.169 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -65.19 -20.11 66.29 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.282 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.809 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 3.0 mm-40 -83.79 -179.35 7.27 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.59 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.84 HD23 HG13 ' A' ' 41' ' ' VAL . 24.1 tp -120.57 140.53 51.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.028 0.442 . . . . 0.0 112.085 -178.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -84.2 146.45 27.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.65 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.564 HG22 ' HG ' ' A' ' 29' ' ' LEU . 45.3 pt -131.36 160.99 41.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.192 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -116.71 167.24 11.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.073 0.464 . . . . 0.0 111.386 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.441 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 52.1 pttt -67.21 -14.86 63.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.79 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -140.0 22.21 2.44 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.671 -0.411 . . . . 0.0 111.561 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.416 ' HG3' ' CD2' ' A' ' 29' ' ' LEU . 40.4 tp10 -99.67 135.42 41.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.899 0.38 . . . . 0.0 110.516 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.527 ' HG2' HG23 ' A' ' 8' ' ' ILE . 69.2 mtp180 -90.53 120.77 31.9 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.754 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.564 ' HG ' HG22 ' A' ' 23' ' ' ILE . 0.3 OUTLIER -115.69 148.0 40.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.577 -179.601 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -101.62 109.77 21.63 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.079 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.456 ' HA ' HG23 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -81.02 152.63 27.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.383 0.611 . . . . 0.0 112.255 -179.05 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.5 mp -110.93 -25.4 9.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.07 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -160.99 117.41 2.26 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.745 0.307 . . . . 0.0 111.067 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.416 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.5 p-10 -110.8 7.18 21.89 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 86.0 p -74.1 -36.57 64.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.82 0.343 . . . . 0.0 111.371 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -81.1 161.41 24.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.371 0.605 . . . . 0.0 112.31 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.454 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 17.6 p -57.55 -40.5 79.02 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.007 178.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.471 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 43.8 m95 -93.94 131.17 39.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.918 177.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.422 ' HB3' HD21 ' A' ' 31' ' ' LEU . 32.0 m0 -102.67 129.68 49.34 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.433 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 44.3 ttt180 -91.78 127.17 37.13 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.84 HG13 HD23 ' A' ' 21' ' ' LEU . 3.2 p -140.16 161.97 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -177.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.526 ' HA ' HG22 ' A' ' 48' ' ' THR . 59.9 ttt85 -126.23 145.51 50.37 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.723 0.297 . . . . 0.0 111.202 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.469 ' HB2' HD21 ' A' ' 21' ' ' LEU . 61.8 t30 -113.19 161.54 17.04 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.917 0.389 . . . . 0.0 111.824 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.98 -21.05 58.01 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.262 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.65 6.35 15.45 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 68.05 26.07 7.37 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.949 0.404 . . . . 0.0 111.26 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.527 ' O ' HD13 ' A' ' 21' ' ' LEU . 75.0 ttt180 -110.23 123.44 49.78 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.526 HG22 ' HA ' ' A' ' 42' ' ' ARG . 52.5 p -121.74 156.94 32.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.749 0.309 . . . . 0.0 111.208 -179.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.451 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -173.48 171.03 44.18 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.365 -0.922 . . . . 0.0 113.308 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.429 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 90.4 m-85 -103.54 112.53 25.49 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.747 0.308 . . . . 0.0 111.28 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.559 HG13 ' HB3' ' A' ' 20' ' ' GLU . 2.9 m -132.29 114.74 14.85 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.03 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.471 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 8.7 Cg_exo -73.63 36.99 0.4 Allowed 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.721 2.281 . . . . 0.0 113.026 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.466 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -67.69 92.98 0.35 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 120.865 0.364 . . . . 0.0 111.267 -179.584 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -62.17 -17.55 58.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.281 178.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.515 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.0 m-85 -59.93 -14.82 17.48 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.579 HG23 ' C ' ' A' ' 8' ' ' ILE . 8.1 p -112.72 140.44 32.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.083 0.468 . . . . 0.0 110.835 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -136.82 165.24 26.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.064 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.797 ' HA ' HG12 ' A' ' 7' ' ' VAL . 92.0 mtt180 -69.55 139.43 53.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.915 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.7 pttp . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.738 179.977 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.478 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.1 t . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.577 0.227 . . . . 0.0 110.627 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.8 mt -111.67 118.32 57.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.673 0.273 . . . . 0.0 111.709 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.6 HG12 ' HA ' ' A' ' 58' ' ' ARG . 21.4 m -134.11 160.67 41.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.034 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.467 ' HA ' ' HA ' ' A' ' 28' ' ' ARG . 33.6 mt -121.07 124.05 71.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.312 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.76 125.2 28.61 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.932 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.1 mttm -90.99 -9.24 46.72 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.58 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 12.5 m-90 -146.64 145.98 30.24 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.867 0.365 . . . . 0.0 110.876 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -69.91 125.23 26.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.995 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.455 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 65.6 t80 -127.81 141.16 51.65 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.502 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -104.19 136.66 43.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.922 0.392 . . . . 0.0 110.897 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.699 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.26 133.04 54.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.384 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -65.77 -34.27 77.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.187 0.518 . . . . 0.0 110.182 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -131.83 163.94 27.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.329 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -63.52 -31.15 72.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.864 0.364 . . . . 0.0 111.335 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -63.38 -27.25 69.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.301 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.699 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -82.6 -179.19 7.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.27 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.518 HD21 ' O ' ' A' ' 47' ' ' ARG . 6.4 mp -124.73 143.89 50.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.007 0.432 . . . . 0.0 111.345 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -81.44 148.78 29.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.407 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.455 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 49.8 pt -130.96 162.89 38.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.262 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -116.29 171.51 7.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.811 0.339 . . . . 0.0 110.873 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.459 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 16.1 ptpt -69.45 -10.99 60.42 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.7 p-10 -138.46 25.32 2.65 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.714 -0.395 . . . . 0.0 111.366 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.413 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 78.6 tt0 -101.08 139.16 37.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.783 0.325 . . . . 0.0 111.162 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.555 ' C ' HD22 ' A' ' 29' ' ' LEU . 35.8 ptt180 -99.01 121.25 40.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.95 0.405 . . . . 0.0 111.305 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.555 HD22 ' C ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -115.28 153.98 29.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.555 -179.564 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -101.96 112.31 24.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.687 0.28 . . . . 0.0 111.517 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.478 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 40.2 mt -78.19 145.03 35.82 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.928 0.394 . . . . 0.0 111.455 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.8 mp -111.27 -27.09 8.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.324 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -157.52 115.93 3.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.853 0.359 . . . . 0.0 111.038 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.458 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -107.14 4.14 26.5 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.3 t -68.94 -36.66 78.22 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.865 0.364 . . . . 0.0 111.441 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -81.83 159.18 23.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.859 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 86.1 m -59.82 -35.66 75.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.194 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.527 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 8.8 m0 -99.99 125.2 45.99 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.458 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 42.5 m0 -94.96 138.44 32.69 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.429 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 66.6 ttt180 -91.83 137.54 32.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.555 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -140.4 161.44 24.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.619 -0.433 . . . . 0.0 112.134 -178.146 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.484 ' HB2' HG22 ' A' ' 48' ' ' THR . 46.1 ttp180 -123.48 143.88 49.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.784 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -111.2 162.88 14.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.431 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.9 -19.89 20.23 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.739 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.25 6.0 15.43 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 69.96 24.77 5.05 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-O 120.786 0.327 . . . . 0.0 110.983 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.518 ' O ' HD21 ' A' ' 21' ' ' LEU . 62.7 ttt180 -111.09 128.77 55.99 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.048 179.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.484 HG22 ' HB2' ' A' ' 42' ' ' ARG . 72.8 p -116.91 156.82 26.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.926 0.393 . . . . 0.0 111.16 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.59 178.4 43.91 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.038 -0.601 . . . . 0.0 112.087 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.429 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 97.1 m-85 -106.86 112.31 25.22 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.924 0.392 . . . . 0.0 111.109 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.503 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.7 t -124.54 112.16 27.7 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.658 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.527 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 7.5 Cg_exo -72.9 36.6 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.514 2.143 . . . . 0.0 112.759 178.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' HG12 ' A' ' 56' ' ' VAL . 61.9 p -65.06 97.72 0.26 Allowed 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 120.599 0.238 . . . . 0.0 110.899 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -80.73 -3.68 51.7 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.078 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.58 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 81.1 m-85 -76.74 -1.61 28.88 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 53' ' ' SER . 7.3 p -111.66 142.03 25.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 121.076 0.465 . . . . 0.0 110.859 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -125.86 145.4 50.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.028 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.6 ' HA ' HG12 ' A' ' 7' ' ' VAL . 64.6 mtp180 -69.3 135.69 50.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.962 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.438 ' HD2' HD12 ' A' ' 8' ' ' ILE . 53.2 mttp . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.865 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.6 t . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 120.955 0.407 . . . . 0.0 111.362 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.3 mt -117.54 123.53 71.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.638 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.698 HG12 ' HA ' ' A' ' 58' ' ' ARG . 29.8 m -134.37 159.6 41.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.221 0.534 . . . . 0.0 112.053 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.779 HG23 ' HG2' ' A' ' 28' ' ' ARG . 24.2 mt -117.15 127.13 74.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.093 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.691 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.38 148.72 43.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.95 -179.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -113.85 -16.48 12.23 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.589 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.509 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 11.6 m-90 -145.21 148.39 33.48 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.913 0.387 . . . . 0.0 110.325 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -68.49 126.51 29.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.667 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.425 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 45.7 t80 -127.25 135.78 51.09 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.163 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.3 m -105.52 120.77 42.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.026 0.441 . . . . 0.0 110.081 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.514 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -52.92 143.46 16.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.048 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -129.51 40.45 3.59 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.185 0.517 . . . . 0.0 111.473 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.521 ' H ' ' HG2' ' A' ' 20' ' ' GLU . 86.8 mm-40 -135.52 176.41 8.7 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.861 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -78.24 -38.68 42.41 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -122.95 77.69 1.48 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.218 0.532 . . . . 0.0 109.94 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.672 ' C ' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -138.95 -179.39 5.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.408 -177.715 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.802 HD11 ' HG2' ' A' ' 47' ' ' ARG . 8.9 mp -137.01 137.39 39.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.101 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.9 p-10 -80.18 150.07 30.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.995 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 46.4 pt -129.44 164.17 32.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 120.655 0.264 . . . . 0.0 110.7 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -112.91 -177.59 3.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.28 0.562 . . . . 0.0 111.451 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -61.44 -52.25 65.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.827 -178.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -105.91 -7.89 17.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.418 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 80.5 tt0 -54.67 146.21 17.3 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.789 0.328 . . . . 0.0 111.515 -179.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.779 ' HG2' HG23 ' A' ' 8' ' ' ILE . 82.4 mtm180 -107.32 125.48 51.23 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.446 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.571 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -116.26 156.24 26.94 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.796 0.331 . . . . 0.0 110.738 179.737 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.466 ' O ' HD22 ' A' ' 32' ' ' LEU . 5.7 m-90 -104.68 106.61 17.18 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.647 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.546 ' HA ' HG23 ' A' ' 41' ' ' VAL . 25.9 mt -68.53 143.42 54.94 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.513 0.673 . . . . 0.0 112.13 -178.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.596 HD23 ' HA ' ' A' ' 41' ' ' VAL . 3.9 mm? -112.48 -35.86 5.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.631 -178.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -157.15 115.33 3.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.432 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.444 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 38.4 p-10 -111.99 4.31 18.04 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.3 m -67.47 -39.3 85.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.791 0.329 . . . . 0.0 111.606 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -81.27 159.59 24.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.782 -179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -35.24 68.61 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.473 ' CE3' ' HG3' ' A' ' 52' ' ' PRO . 16.8 m95 -96.22 131.18 42.97 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 177.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.472 ' CZ3' HD11 ' A' ' 31' ' ' LEU . 37.7 m0 -104.07 135.44 45.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.168 0.509 . . . . 0.0 112.313 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 49' ' ' GLY . 75.2 ttt180 -94.65 130.29 41.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.596 ' HA ' HD23 ' A' ' 32' ' ' LEU . 1.4 p -137.03 157.3 35.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.443 ' HB2' HD21 ' A' ' 32' ' ' LEU . 37.8 ttm180 -120.55 141.58 50.13 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.075 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -113.18 163.18 15.09 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.676 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.73 -18.94 5.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.17 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.43 6.43 10.24 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 66.05 26.1 10.81 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.052 0.453 . . . . 0.0 111.043 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.802 ' HG2' HD11 ' A' ' 21' ' ' LEU . 56.7 ttp180 -112.32 143.55 43.24 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.463 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.404 HG22 ' CB ' ' A' ' 42' ' ' ARG . 73.1 p -132.76 161.61 33.61 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.791 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.649 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -177.81 -176.34 45.74 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.966 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.438 ' O ' ' HB3' ' A' ' 20' ' ' GLU . 93.6 m-85 -110.69 115.19 29.14 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -178.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 51' ' ' VAL . 4.4 m -137.91 112.75 8.97 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.971 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.473 ' HG3' ' CE3' ' A' ' 38' ' ' TRP . 2.7 Cg_exo -74.77 56.35 4.09 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.145 1.897 . . . . 0.0 111.371 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.771 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -73.08 82.24 1.27 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.073 0.463 . . . . 0.0 111.707 -178.83 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -64.64 -14.78 59.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.638 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.509 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.6 m-85 -71.1 -7.17 44.72 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 53' ' ' SER . 9.3 p -110.03 146.58 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.94 0.4 . . . . 0.0 110.888 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -136.59 162.43 33.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.506 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.698 ' HA ' HG12 ' A' ' 7' ' ' VAL . 77.5 mtp180 -69.39 140.89 54.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.771 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.979 179.853 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.495 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 57.9 t . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.744 0.307 . . . . 0.0 110.251 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.1 mt -103.11 119.25 51.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.665 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.665 HG12 ' HA ' ' A' ' 58' ' ' ARG . 35.1 m -132.29 160.24 42.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.564 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.687 ' C ' HG23 ' A' ' 56' ' ' VAL . 26.0 mm -118.48 123.96 72.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.922 0.392 . . . . 0.0 111.329 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.527 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -76.38 120.52 21.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.514 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -93.01 -6.74 47.64 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.594 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 6.8 m-90 -143.99 143.78 31.37 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.796 0.331 . . . . 0.0 110.399 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -71.38 121.66 18.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.048 0.451 . . . . 0.0 111.722 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.433 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 54.2 t80 -127.18 135.52 50.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.692 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.4 m -102.73 141.73 35.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.016 0.436 . . . . 0.0 110.93 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.631 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.76 135.17 51.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.675 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -84.97 -4.87 59.31 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.697 0.284 . . . . 0.0 110.959 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.438 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 74.9 mt-30 -143.9 171.73 13.83 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -76.37 -28.79 56.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.894 0.378 . . . . 0.0 111.775 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -81.36 -6.7 59.19 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.631 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.1 mt-10 -86.04 179.09 7.04 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.736 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.857 HD23 HG13 ' A' ' 41' ' ' VAL . 28.8 tp -124.27 126.57 46.29 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.997 0.427 . . . . 0.0 111.672 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -68.95 149.51 48.76 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.027 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.597 HG22 ' HG ' ' A' ' 29' ' ' LEU . 46.4 pt -134.88 165.24 31.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.249 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -118.88 166.97 12.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.055 0.455 . . . . 0.0 111.353 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.414 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 55.4 pttt -67.22 -12.56 60.38 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -139.73 21.4 2.5 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.364 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -97.88 141.15 31.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.901 0.381 . . . . 0.0 110.636 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.567 ' HB3' HD12 ' A' ' 8' ' ' ILE . 35.9 ptt-85 -98.72 120.63 39.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.571 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.67 HD22 ' N ' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -113.75 148.17 36.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.032 0.444 . . . . 0.0 111.693 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 15.8 m-90 -99.83 111.31 23.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.979 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.495 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 62.4 mt -72.95 147.32 45.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.809 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.777 HD13 ' HG2' ' A' ' 40' ' ' ARG . 5.2 mp -109.51 -30.89 7.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.415 -179.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -133.72 -66.37 0.64 Allowed 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 120.809 0.338 . . . . 0.0 111.483 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.466 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 3.2 p30 51.6 16.41 0.45 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.621 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.6 m -77.93 -35.87 50.01 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.912 0.387 . . . . 0.0 110.89 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.4 mmtt -92.34 175.3 6.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.646 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.9 m -59.15 -27.86 66.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.723 178.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.489 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 49.4 m95 -99.75 127.64 45.88 Favored 'General case' 0 CA--C 1.522 -0.114 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 177.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.466 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 38.4 m0 -108.23 128.51 54.78 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -176.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.777 ' HG2' HD13 ' A' ' 32' ' ' LEU . 23.5 ttm180 -87.84 135.94 33.17 Favored 'General case' 0 C--O 1.231 0.087 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 177.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.857 HG13 HD23 ' A' ' 21' ' ' LEU . 1.4 p -145.36 161.9 12.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.221 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HA ' HG22 ' A' ' 48' ' ' THR . 65.5 ttt180 -120.84 144.06 48.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.009 0.433 . . . . 0.0 111.606 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.855 ' HB2' HD21 ' A' ' 21' ' ' LEU . 55.9 t30 -114.33 161.12 18.31 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.319 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.38 -20.39 29.25 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.816 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.85 6.4 13.24 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 67.69 26.02 7.99 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.062 0.458 . . . . 0.0 111.121 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.633 ' O ' HD13 ' A' ' 21' ' ' LEU . 85.6 mtt-85 -111.72 128.54 56.12 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.647 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.444 HG22 ' HA ' ' A' ' 42' ' ' ARG . 30.5 p -125.61 151.4 46.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.336 -179.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.551 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -172.47 172.64 45.04 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.685 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.467 ' CE1' ' HB2' ' A' ' 40' ' ' ARG . 52.6 m-85 -96.75 108.55 21.22 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.48 HG13 ' HB3' ' A' ' 20' ' ' GLU . 4.2 m -126.91 111.36 22.06 Favored Pre-proline 0 C--N 1.333 -0.116 0 CA-C-N 116.794 -0.185 . . . . 0.0 111.208 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.489 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 60.5 Cg_endo -72.23 46.46 0.93 Allowed 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 121.788 1.659 . . . . 0.0 111.733 178.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.68 ' O ' HG12 ' A' ' 56' ' ' VAL . 9.1 p -72.99 81.62 1.21 Allowed 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 120.973 0.416 . . . . 0.0 111.112 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 p30 -58.05 -19.45 31.67 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.113 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.594 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.6 m-85 -57.22 -16.92 9.36 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.724 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.687 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.2 p -108.98 140.57 27.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.045 0.45 . . . . 0.0 110.859 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -135.42 162.56 32.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.026 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.665 ' HA ' HG12 ' A' ' 7' ' ' VAL . 41.1 ttm180 -70.08 139.14 52.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.912 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.3 tttp . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.953 -179.929 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.412 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 53.2 t . . . . . 0 N--CA 1.455 -0.208 0 CA-C-O 120.711 0.291 . . . . 0.0 110.428 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.1 mt -109.81 119.79 59.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.249 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.628 HG12 ' CA ' ' A' ' 58' ' ' ARG . 34.1 m -134.03 161.11 41.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.85 0.357 . . . . 0.0 111.244 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.669 HD12 ' HG2' ' A' ' 28' ' ' ARG . 17.2 mm -115.89 121.95 68.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.034 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.573 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -76.12 126.77 31.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.722 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -99.67 -10.6 21.76 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.596 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.3 m-90 -141.96 145.26 34.3 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.839 0.352 . . . . 0.0 110.462 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -72.53 122.64 21.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.627 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.422 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 55.8 t80 -127.71 139.03 52.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.723 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.3 m -103.14 134.47 46.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.001 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.76 ' HB1' ' HG3' ' A' ' 20' ' ' GLU . . . -56.43 142.26 39.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.965 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -88.75 -4.56 58.49 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -149.45 176.95 10.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.637 0.256 . . . . 0.0 110.662 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -75.78 -34.18 60.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.127 0.489 . . . . 0.0 110.694 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -62.45 -35.98 81.0 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.146 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.894 ' HB2' HG13 ' A' ' 51' ' ' VAL . 0.9 OUTLIER -81.7 178.61 8.23 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.469 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.57 ' O ' HG11 ' A' ' 51' ' ' VAL . 10.2 mp -126.12 161.33 27.88 Favored 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 121.32 0.581 . . . . 0.0 112.093 -178.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -90.53 148.1 22.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.162 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.5 HG22 HD11 ' A' ' 29' ' ' LEU . 40.2 pt -130.06 163.21 36.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.441 ' HB3' ' HB2' ' A' ' 27' ' ' GLU . 86.4 tttt -117.72 164.54 14.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.991 0.424 . . . . 0.0 111.277 -178.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.439 ' N ' ' HG2' ' A' ' 24' ' ' LYS . 11.0 ptpp? -63.31 -12.89 33.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -137.75 5.55 2.64 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 24' ' ' LYS . 77.1 tt0 -77.27 146.79 36.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.753 0.311 . . . . 0.0 110.599 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.669 ' HG2' HD12 ' A' ' 8' ' ' ILE . 86.3 mtm180 -94.96 119.64 33.83 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 120.979 0.418 . . . . 0.0 110.875 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.608 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.6 mm? -113.77 142.41 46.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.468 -179.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -103.32 109.63 21.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.695 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.412 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 90.6 mt -79.68 151.12 30.67 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.312 0.577 . . . . 0.0 111.67 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -114.99 -29.01 6.82 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.804 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -161.4 118.36 2.23 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.363 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.456 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.1 p-10 -110.33 2.89 19.38 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.6 m -63.58 -38.9 92.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.955 0.407 . . . . 0.0 111.367 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -82.8 159.49 22.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.675 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.08 -35.6 71.62 Favored 'General case' 0 C--O 1.23 0.065 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.448 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 45.1 m95 -94.85 132.05 40.08 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.456 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 40.1 m0 -105.9 132.47 51.97 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -177.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -86.87 131.96 33.96 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.608 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.6 p -140.7 159.56 24.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -177.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.503 ' CB ' HG22 ' A' ' 48' ' ' THR . 44.2 ttm180 -123.79 141.78 51.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.568 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -110.38 162.26 14.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.588 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.36 -19.93 39.57 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.587 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.79 5.01 14.67 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.8 t30 71.88 26.4 2.96 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 110.886 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.443 ' HB2' HD21 ' A' ' 21' ' ' LEU . 99.5 mtt180 -112.47 133.98 54.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.127 179.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.503 HG22 ' CB ' ' A' ' 42' ' ' ARG . 73.5 p -124.58 148.1 48.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.901 0.381 . . . . 0.0 111.205 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.715 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -163.23 -178.67 37.17 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.628 -179.468 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 92.0 m-85 -113.27 97.05 6.24 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.894 HG13 ' HB2' ' A' ' 20' ' ' GLU . 0.2 OUTLIER -112.97 121.11 39.13 Favored Pre-proline 0 C--N 1.329 -0.315 0 C-N-CA 121.341 -0.144 . . . . 0.0 110.753 178.288 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.448 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 96.0 Cg_endo -78.26 43.33 1.39 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.018 1.812 . . . . 0.0 111.697 177.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.563 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -71.01 87.84 0.75 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.868 0.366 . . . . 0.0 111.343 -179.292 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -68.32 -11.63 59.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.524 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.596 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 98.7 m-85 -69.09 -10.47 57.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.573 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.3 p -114.86 141.49 31.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.996 0.427 . . . . 0.0 110.691 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -146.88 161.58 40.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.858 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.628 ' CA ' HG12 ' A' ' 7' ' ' VAL . 79.5 ttt-85 -69.84 138.84 52.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.881 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.527 ' HG2' ' HG2' ' A' ' 58' ' ' ARG . 74.6 mmtt . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.916 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.421 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 55.2 t . . . . . 0 N--CA 1.452 -0.327 0 CA-C-O 120.82 0.343 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.0 mm -97.05 118.45 43.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.166 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.833 HG12 ' HA ' ' A' ' 58' ' ' ARG . 30.5 m -134.33 162.86 38.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.184 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.78 HD12 ' HG2' ' A' ' 28' ' ' ARG . 26.8 mm -120.96 130.38 74.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.035 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.18 150.92 38.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.844 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -117.09 -14.17 10.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.748 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.402 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 8.6 m-90 -148.69 149.98 32.4 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.93 0.395 . . . . 0.0 110.962 -179.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -74.18 121.92 21.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.14 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -127.4 137.43 52.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.997 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.3 m -99.76 137.32 38.4 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.287 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.653 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -51.19 129.57 24.64 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.927 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -62.4 -23.74 67.0 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.985 0.422 . . . . 0.0 110.449 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.455 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 96.1 mt-30 -139.47 172.91 12.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.071 179.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -72.8 -29.39 63.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.926 0.393 . . . . 0.0 111.482 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -72.12 -17.46 61.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.911 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.653 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -86.22 179.61 6.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.725 0.298 . . . . 0.0 110.327 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 43' ' ' ASN . 15.3 tp -118.9 143.57 46.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.22 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -86.0 151.66 23.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.654 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 33.7 pt -134.07 162.48 39.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.73 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -114.22 -176.95 3.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.195 0.522 . . . . 0.0 111.24 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 26.1 mttt -63.56 -52.95 58.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.427 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -109.1 -0.17 19.55 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -57.4 142.48 43.65 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.943 0.401 . . . . 0.0 111.404 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.78 ' HG2' HD12 ' A' ' 8' ' ' ILE . 92.5 mtt180 -94.7 122.29 37.16 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.343 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.641 ' HB3' HG21 ' A' ' 41' ' ' VAL . 3.8 mm? -111.38 145.43 38.9 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 26.6 m-90 -105.47 108.44 19.95 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.554 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.535 HD23 HG23 ' A' ' 41' ' ' VAL . 68.1 mt -72.16 147.42 46.63 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.071 0.463 . . . . 0.0 111.891 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.4 mp -112.6 -28.52 7.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.255 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -158.51 116.41 2.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.804 0.335 . . . . 0.0 111.101 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.445 ' OD2' HD13 ' A' ' 31' ' ' LEU . 96.4 m-20 -110.08 9.12 24.15 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.195 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 87.9 p -77.19 -35.13 56.06 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.923 0.392 . . . . 0.0 110.99 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -82.79 157.44 23.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.424 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -58.44 -36.78 74.18 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.428 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 15.2 m95 -95.51 130.17 42.44 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 177.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.422 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 32.3 m0 -100.91 134.41 43.94 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.16 0.505 . . . . 0.0 112.277 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.451 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 73.5 ttt180 -92.79 133.06 36.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 177.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.641 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.2 p -140.48 147.05 23.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.929 -177.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.406 ' CB ' ' HB ' ' A' ' 48' ' ' THR . 58.8 ttt180 -118.54 153.3 34.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.653 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.763 ' HB3' HD21 ' A' ' 21' ' ' LEU . 53.4 p-10 -122.49 171.8 8.83 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.033 0.444 . . . . 0.0 111.808 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.36 -15.08 46.34 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.174 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.88 6.08 10.01 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 66.32 23.18 10.76 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.885 0.374 . . . . 0.0 111.269 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.601 ' O ' HD13 ' A' ' 21' ' ' LEU . 66.9 mtt180 -119.53 129.41 54.67 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.406 ' HB ' ' CB ' ' A' ' 42' ' ' ARG . 5.7 t -135.99 155.85 49.63 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.684 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.528 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.81 -173.66 36.06 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 120.628 -0.796 . . . . 0.0 113.021 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.451 ' HA ' ' HA ' ' A' ' 40' ' ' ARG . 98.1 m-85 -99.66 107.62 19.78 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.69 HG21 ' O ' ' A' ' 21' ' ' LEU . 20.5 t -125.56 119.83 24.6 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.276 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.428 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 77.4 Cg_endo -83.21 39.63 0.84 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.217 1.945 . . . . 0.0 111.733 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.632 ' O ' HG12 ' A' ' 56' ' ' VAL . 25.6 p -68.5 90.05 0.37 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.877 0.37 . . . . 0.0 111.617 -179.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -65.94 -13.59 60.04 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.45 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -60.22 -14.4 17.49 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.632 HG12 ' O ' ' A' ' 53' ' ' SER . 7.7 p -111.08 147.16 15.29 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 120.847 0.356 . . . . 0.0 110.759 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -146.07 164.9 30.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.64 -179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.833 ' HA ' HG12 ' A' ' 7' ' ' VAL . 91.9 mtm-85 -68.4 141.86 55.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.332 . . . . 0.0 110.562 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.249 -0.881 . . . . 0.0 110.969 179.959 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 68.5 t . . . . . 0 N--CA 1.456 -0.174 0 CA-C-O 120.743 0.306 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.434 HG23 ' CD1' ' A' ' 30' ' ' TRP . 25.4 mt -112.87 119.0 59.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.848 0.356 . . . . 0.0 111.403 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.618 HG12 ' HA ' ' A' ' 58' ' ' ARG . 34.2 m -132.68 161.65 41.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.07 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.64 ' C ' HG23 ' A' ' 56' ' ' VAL . 30.7 mt -117.43 129.38 74.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.957 0.408 . . . . 0.0 111.339 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.619 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.85 148.29 38.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.362 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -113.31 -17.81 12.21 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.693 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.472 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.9 m-90 -143.62 134.54 25.4 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.965 0.412 . . . . 0.0 111.014 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -60.04 125.32 23.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.626 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -127.54 141.32 51.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.982 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 86.8 m -106.38 138.35 42.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.404 179.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.618 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.92 132.27 49.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.728 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -66.79 -24.67 66.21 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.138 0.494 . . . . 0.0 110.58 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.409 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 96.3 mt-30 -136.12 170.67 15.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.103 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -72.46 -28.11 62.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.79 0.328 . . . . 0.0 111.168 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -69.96 -21.2 63.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.794 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.618 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -82.9 -179.24 7.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.839 0.352 . . . . 0.0 110.556 179.901 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.78 HD21 ' HB3' ' A' ' 43' ' ' ASN . 11.7 tp -118.1 139.92 50.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.323 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -83.54 140.67 32.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.422 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.416 HG22 HD11 ' A' ' 29' ' ' LEU . 32.3 pt -126.56 165.39 24.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.53 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.4 mttm -114.35 -178.68 3.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.12 0.486 . . . . 0.0 111.523 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -64.01 -52.14 60.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.396 -178.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -106.44 -6.42 18.21 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.78 146.75 30.36 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.918 0.39 . . . . 0.0 111.022 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.604 ' HG2' HG23 ' A' ' 8' ' ' ILE . 23.7 mtm105 -101.3 124.86 47.66 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.875 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.533 HD22 ' C ' ' A' ' 28' ' ' ARG . 1.3 mm? -114.32 149.78 35.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.157 0.503 . . . . 0.0 111.644 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.434 ' CD1' HG23 ' A' ' 6' ' ' ILE . 5.2 m-90 -102.17 115.73 31.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.419 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.709 ' C ' HD23 ' A' ' 32' ' ' LEU . 40.6 mt -79.88 146.22 32.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.367 0.603 . . . . 0.0 112.337 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.709 HD23 ' C ' ' A' ' 31' ' ' LEU . 1.7 mt -108.94 -35.0 6.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.308 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -159.61 117.59 2.73 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.11 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.442 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.8 p-10 -107.41 4.94 26.84 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.163 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.9 m -69.11 -36.56 77.67 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.776 0.322 . . . . 0.0 111.696 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -84.06 156.84 22.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.101 0.477 . . . . 0.0 112.035 -179.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 60.2 m -55.75 -31.29 62.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.368 177.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.2 m95 -101.59 134.25 45.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.442 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.5 m0 -103.82 138.01 41.02 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -97.13 130.45 44.39 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.526 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.5 OUTLIER -139.56 148.62 23.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 120.59 -0.444 . . . . 0.0 112.023 -177.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -122.99 146.53 47.54 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.886 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.78 ' HB3' HD21 ' A' ' 21' ' ' LEU . 52.3 p-10 -113.44 171.2 7.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.038 0.447 . . . . 0.0 112.022 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.22 -16.2 31.37 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.991 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.61 5.04 16.61 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 69.93 22.09 6.0 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.75 0.309 . . . . 0.0 111.143 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -116.46 128.62 55.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.11 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.5 t -134.04 151.46 51.43 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.318 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.445 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -160.77 -173.43 29.36 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.807 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -100.06 104.55 16.13 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 111.106 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.57 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.3 t -123.88 112.29 28.84 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.023 179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.8 44.34 1.27 Allowed 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 121.794 1.662 . . . . 0.0 111.437 177.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.648 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.9 p -72.92 81.97 1.2 Allowed 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 120.88 0.371 . . . . 0.0 111.467 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -64.76 -13.36 54.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.338 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.472 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.9 m-85 -62.94 -10.92 15.35 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 53' ' ' SER . 7.3 p -108.82 141.78 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-O 121.05 0.453 . . . . 0.0 111.033 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -130.17 158.46 39.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.651 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.618 ' HA ' HG12 ' A' ' 7' ' ' VAL . 24.3 ttm105 -70.22 129.65 39.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.925 0.393 . . . . 0.0 111.25 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.251 179.723 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.55 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 99.6 t . . . . . 0 C--O 1.233 0.186 0 CA-C-O 120.752 0.31 . . . . 0.0 110.586 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mt -101.08 119.12 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.877 0.37 . . . . 0.0 111.235 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.626 HG12 ' HA ' ' A' ' 58' ' ' ARG . 34.9 m -131.96 163.03 38.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.545 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.647 HG23 ' HG2' ' A' ' 28' ' ' ARG . 47.3 mt -122.89 127.59 74.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.77 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.566 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.08 145.25 44.57 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.952 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -108.83 -18.01 13.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.887 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.533 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 9.7 m-90 -143.87 147.54 34.19 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.844 0.354 . . . . 0.0 111.595 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.495 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 60.5 t0 -69.89 123.14 20.73 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.179 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.425 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 65.1 t80 -128.52 134.88 48.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.666 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 92.6 m -99.5 140.97 32.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.413 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.674 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -53.37 131.49 37.87 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.599 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -67.41 -18.32 65.07 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.384 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.46 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 93.0 mt-30 -142.6 173.7 11.3 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -76.24 -22.27 55.36 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.678 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -82.11 -7.04 59.6 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.674 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.1 mt-10 -92.88 -179.96 5.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.92 0.39 . . . . 0.0 110.744 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.969 HD23 HG13 ' A' ' 41' ' ' VAL . 46.3 tp -116.59 140.51 49.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.554 -178.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -85.62 150.06 24.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.837 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 31.2 pt -134.71 164.1 34.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.339 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -116.13 -175.87 2.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.916 0.389 . . . . 0.0 111.486 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.533 ' HD3' ' HA ' ' A' ' 11' ' ' TRP . 13.9 mmtt -64.67 -48.17 75.72 Favored 'General case' 0 C--N 1.334 -0.097 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -112.8 -4.72 13.96 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 73.0 tt0 -58.51 143.03 47.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.905 0.384 . . . . 0.0 111.422 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.647 ' HG2' HG23 ' A' ' 8' ' ' ILE . 90.7 mtt180 -99.74 126.12 45.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.628 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.582 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.3 mm? -114.67 146.45 40.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.002 0.429 . . . . 0.0 111.731 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -103.5 107.03 17.7 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.268 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.55 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 66.3 mt -72.9 148.54 44.26 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.117 0.485 . . . . 0.0 111.652 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -111.97 -29.01 7.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.023 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -158.97 116.97 2.86 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.52 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.454 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 36.6 p-10 -111.26 9.31 21.71 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.2 p -70.28 -36.71 74.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.919 0.39 . . . . 0.0 111.181 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -85.13 155.93 21.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.557 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -35.39 61.36 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.5 m95 -95.62 135.34 37.43 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.454 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 41.9 m0 -109.13 133.17 53.36 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -177.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.433 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 46.4 ttt180 -87.53 134.44 33.61 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.969 HG13 HD23 ' A' ' 21' ' ' LEU . 1.5 p -145.78 157.35 12.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.824 -178.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.41 ' CB ' HG22 ' A' ' 48' ' ' THR . 37.8 ttm180 -121.27 143.46 49.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.389 -179.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.828 ' HB2' HD21 ' A' ' 21' ' ' LEU . 54.3 t30 -113.49 161.74 16.99 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.372 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.94 -21.33 29.25 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.546 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.76 5.76 10.54 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.9 m120 68.54 23.73 7.24 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 120.841 0.353 . . . . 0.0 111.046 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.509 ' O ' HD13 ' A' ' 21' ' ' LEU . 40.9 ttm180 -108.86 128.54 55.0 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.121 -0.491 . . . . 0.0 109.816 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.41 HG22 ' CB ' ' A' ' 42' ' ' ARG . 81.7 p -119.67 150.41 40.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.067 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.461 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -169.23 171.68 43.14 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.459 -0.876 . . . . 0.0 113.217 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.5 m-85 -102.68 106.37 17.0 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.574 0.225 . . . . 0.0 111.493 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.698 HG11 ' O ' ' A' ' 21' ' ' LEU . 11.1 m -123.08 119.21 27.8 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.327 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -77.31 33.11 0.43 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.147 1.898 . . . . 0.0 112.067 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.8 p -59.1 100.78 0.08 Allowed 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.644 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -81.4 -4.65 56.39 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 177.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -72.65 -7.61 51.21 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.538 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.601 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.7 p -118.81 142.43 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 CA-C-O 120.936 0.398 . . . . 0.0 110.563 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -141.32 161.22 38.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.754 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.626 ' HA ' HG12 ' A' ' 7' ' ' VAL . 27.5 ttm180 -69.93 134.72 48.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.027 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.518 ' HD2' HD12 ' A' ' 8' ' ' ILE . 79.8 tttt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.791 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.481 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.0 t . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 120.722 0.296 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mm -103.21 109.86 28.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.414 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.416 HG12 ' CA ' ' A' ' 58' ' ' ARG . 13.1 m -128.85 162.23 36.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.771 0.319 . . . . 0.0 111.444 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.591 ' C ' HG23 ' A' ' 56' ' ' VAL . 22.8 mt -124.06 122.89 65.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.821 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.59 117.03 17.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.391 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -91.53 -5.35 54.27 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.572 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.2 m-90 -144.65 142.04 29.81 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.906 0.384 . . . . 0.0 110.528 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -70.09 120.39 15.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.584 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.432 ' HB3' HD11 ' A' ' 23' ' ' ILE . 49.4 t80 -127.27 134.13 50.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.556 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.3 m -101.25 141.95 33.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.942 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.662 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.06 135.56 56.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.703 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -83.27 -4.52 58.51 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.074 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.04 168.47 19.93 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.071 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -73.82 -35.34 64.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.443 . . . . 0.0 112.171 -178.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -76.15 -9.72 58.85 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.346 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.662 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -82.4 -178.52 7.09 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.008 0.432 . . . . 0.0 110.855 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.824 HD21 ' HB2' ' A' ' 43' ' ' ASN . 8.9 tp -122.82 138.94 54.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.79 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -83.0 149.08 27.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.439 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.528 HG22 HD11 ' A' ' 29' ' ' LEU . 38.8 pt -134.22 160.8 41.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.332 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 56.0 mtmt -116.0 168.16 10.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.09 0.471 . . . . 0.0 111.32 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.417 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 47.3 pttt -67.36 -11.43 57.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -141.11 27.24 1.97 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.156 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.422 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 84.8 tt0 -102.44 135.64 43.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.791 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.455 ' C ' HD22 ' A' ' 29' ' ' LEU . 63.6 mtt85 -86.66 119.96 27.46 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.02 0.438 . . . . 0.0 110.852 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.58 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.3 mm? -111.05 143.1 42.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.456 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.476 ' C ' HG23 ' A' ' 41' ' ' VAL . 4.0 m-90 -104.32 105.28 15.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.325 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.481 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 25.3 mt -80.64 148.79 30.09 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.929 0.395 . . . . 0.0 111.091 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.3 mp -110.19 -26.17 9.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.213 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -158.59 115.44 2.79 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.767 0.318 . . . . 0.0 111.042 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 31.9 p-10 -112.24 16.76 19.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.828 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.0 p -78.95 -36.68 41.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.988 0.423 . . . . 0.0 110.976 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -85.29 161.58 19.46 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.771 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 20.7 p -55.74 -41.03 73.34 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.407 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 49.8 m95 -92.48 133.45 35.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.165 178.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.44 ' CE3' HD13 ' A' ' 31' ' ' LEU . 38.4 m0 -106.89 132.59 52.67 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -86.97 132.94 33.64 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.58 HG21 ' HB3' ' A' ' 29' ' ' LEU . 4.2 p -149.0 155.32 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -177.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.412 ' CB ' HG22 ' A' ' 48' ' ' THR . 80.2 ttt180 -124.07 147.15 48.1 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.942 0.401 . . . . 0.0 111.691 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.824 ' HB2' HD21 ' A' ' 21' ' ' LEU . 39.7 t30 -111.19 164.69 12.61 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.699 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.78 -17.99 61.97 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.677 177.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.501 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -81.18 5.89 15.56 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.011 179.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 68.31 25.18 7.15 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.773 0.32 . . . . 0.0 111.713 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.548 ' O ' HD13 ' A' ' 21' ' ' LEU . 82.1 mtt85 -111.56 128.72 56.12 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.412 HG22 ' CB ' ' A' ' 42' ' ' ARG . 77.8 p -117.42 153.87 32.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.967 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.475 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -171.87 168.83 41.96 Favored Glycine 0 CA--C 1.524 0.635 0 C-N-CA 120.512 -0.852 . . . . 0.0 113.567 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -103.33 105.91 16.3 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.593 HG11 ' O ' ' A' ' 21' ' ' LEU . 5.1 m -127.19 112.85 21.56 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 111.604 0.224 . . . . 0.0 111.604 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.407 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 11.8 Cg_exo -71.16 36.23 0.29 Allowed 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 122.6 2.2 . . . . 0.0 112.683 178.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.475 ' OG ' HD11 ' A' ' 23' ' ' ILE . 41.8 t -67.0 93.45 0.28 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.022 0.439 . . . . 0.0 111.897 -178.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -71.07 -9.71 58.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.365 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.572 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.7 m-85 -64.38 -13.34 50.27 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.993 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.591 HG23 ' C ' ' A' ' 8' ' ' ILE . 5.8 p -116.16 143.72 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.12 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -148.56 160.29 43.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.896 0.379 . . . . 0.0 111.357 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.416 ' CA ' HG12 ' A' ' 7' ' ' VAL . 64.4 ttt-85 -72.27 134.81 45.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.4 mttt . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.522 179.134 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.528 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.0 t . . . . . 0 N--CA 1.456 -0.164 0 CA-C-O 120.74 0.305 . . . . 0.0 110.358 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 8.1 mt -103.91 120.39 54.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.388 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.743 HG12 ' CA ' ' A' ' 58' ' ' ARG . 21.0 m -132.41 160.03 42.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.571 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.678 ' C ' HG23 ' A' ' 56' ' ' VAL . 51.7 mt -117.82 122.75 70.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.08 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.512 ' N ' HG23 ' A' ' 56' ' ' VAL . . . -74.84 122.2 23.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.139 0.495 . . . . 0.0 111.71 -178.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -91.39 -2.81 57.21 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.38 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.585 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 8.4 m-90 -145.66 143.51 29.86 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.779 0.323 . . . . 0.0 110.949 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.9 p-10 -72.4 122.71 21.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.198 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.448 ' HE1' HG13 ' A' ' 51' ' ' VAL . 62.4 t80 -128.39 140.47 51.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.17 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.3 m -100.82 136.18 41.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.61 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.792 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -56.97 134.67 55.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.351 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -65.73 -34.33 77.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.086 0.469 . . . . 0.0 110.272 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -128.8 168.38 15.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.233 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -68.01 -34.34 76.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.978 0.418 . . . . 0.0 111.164 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -62.89 -26.26 68.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.085 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.792 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -80.64 -178.68 6.86 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.493 HD12 ' C ' ' A' ' 20' ' ' GLU . 7.3 mp -124.62 145.52 49.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.587 -178.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -83.64 149.81 26.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.028 178.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.435 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 43.8 pt -130.79 166.12 29.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.159 179.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -120.3 166.76 13.07 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.287 0.565 . . . . 0.0 110.962 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 21.2 pttp -66.61 -12.9 60.1 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.739 -179.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -135.4 22.07 3.42 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.208 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -101.08 143.42 31.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.875 0.369 . . . . 0.0 110.592 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.559 ' C ' HD22 ' A' ' 29' ' ' LEU . 26.3 ptt85 -102.86 128.35 49.67 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.935 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.559 HD22 ' C ' ' A' ' 28' ' ' ARG . 0.7 OUTLIER -115.81 151.76 34.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.189 -178.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 8.7 m-90 -100.51 110.63 22.81 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.046 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.528 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 86.7 mt -75.41 145.65 41.41 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.946 0.403 . . . . 0.0 111.573 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.607 HD13 ' HG2' ' A' ' 40' ' ' ARG . 5.3 mp -111.69 -29.87 7.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.007 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -161.02 119.86 2.53 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.863 0.363 . . . . 0.0 110.952 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.44 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.4 p-10 -106.44 1.97 26.0 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.3 m -64.9 -39.17 93.11 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -81.32 158.79 24.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.195 0.521 . . . . 0.0 112.192 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 94.2 m -58.64 -36.22 73.77 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.024 178.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.498 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 21.1 m95 -99.37 125.41 45.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.44 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 41.7 m0 -95.11 138.98 32.09 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -177.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.607 ' HG2' HD13 ' A' ' 32' ' ' LEU . 34.9 ttm180 -92.8 136.27 33.39 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 177.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.579 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.8 OUTLIER -141.51 159.68 21.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.834 -178.325 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -121.6 145.06 48.36 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.242 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.445 ' HB2' HD23 ' A' ' 21' ' ' LEU . 52.0 t30 -111.0 162.76 14.53 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.934 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.12 -23.15 45.06 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.852 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.52 5.46 7.32 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 179.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.3 m120 71.33 26.6 3.3 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 120.874 0.369 . . . . 0.0 110.714 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.403 ' C ' HD21 ' A' ' 21' ' ' LEU . 25.9 mmt85 -106.34 145.75 31.28 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.765 178.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.4 p -135.21 148.84 49.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.723 0.297 . . . . 0.0 111.135 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 40' ' ' ARG . . . -171.15 -172.03 36.95 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.851 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -108.89 112.35 24.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.712 0.291 . . . . 0.0 111.419 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.448 HG13 ' HE1' ' A' ' 13' ' ' TYR . 21.7 t -127.09 113.3 21.74 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.416 178.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.498 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 59.9 Cg_endo -76.94 31.11 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.414 2.076 . . . . 0.0 112.484 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.662 ' O ' HG12 ' A' ' 56' ' ' VAL . 13.8 p -62.43 87.24 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.772 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -72.86 -8.12 54.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.517 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.585 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 99.6 m-85 -71.79 -1.29 13.54 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.678 HG23 ' C ' ' A' ' 8' ' ' ILE . 6.5 p -111.04 144.78 18.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-O 120.877 0.37 . . . . 0.0 110.922 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -136.03 148.79 48.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.988 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.743 ' CA ' HG12 ' A' ' 7' ' ' VAL . 78.2 ttt-85 -70.43 138.97 51.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.868 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 62.3 tttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.861 179.638 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.462 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.7 t . . . . . 0 N--CA 1.455 -0.201 0 CA-C-O 120.738 0.304 . . . . 0.0 110.369 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.9 mt -104.5 121.08 55.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.842 0.353 . . . . 0.0 110.939 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.761 HG12 ' HA ' ' A' ' 58' ' ' ARG . 27.2 m -132.34 162.72 39.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.964 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.751 HG23 ' HG2' ' A' ' 28' ' ' ARG . 24.3 mt -116.76 128.46 74.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.642 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.482 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.63 146.75 44.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.037 0.446 . . . . 0.0 111.119 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.419 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 30.9 mtpp -110.25 -21.9 12.01 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.328 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.517 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.9 m-90 -137.47 142.08 41.55 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.164 0.507 . . . . 0.0 110.975 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -65.37 127.1 30.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.535 -179.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.467 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 68.0 t80 -128.47 140.24 51.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.707 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.9 m -101.91 134.12 45.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.737 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.788 ' HB1' ' HG3' ' A' ' 20' ' ' GLU . . . -51.87 128.23 23.4 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.35 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -67.82 -24.26 65.27 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.953 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -146.42 171.47 14.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.919 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -67.19 -35.04 78.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.928 0.394 . . . . 0.0 111.585 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -58.17 -40.43 81.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.058 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.788 ' HG3' ' HB1' ' A' ' 15' ' ' ALA . 5.5 pt-20 -83.41 -179.55 7.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.075 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.653 HD21 ' CB ' ' A' ' 47' ' ' ARG . 8.6 mp -122.22 162.26 21.72 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -89.33 144.43 26.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.92 178.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.597 HG22 HD11 ' A' ' 29' ' ' LEU . 34.6 pt -128.95 163.98 32.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.438 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 96.4 mttt -111.94 -179.12 3.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.339 0.59 . . . . 0.0 111.442 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 32.9 ttmt -61.8 -51.99 66.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.808 -179.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -105.82 -7.46 18.29 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.438 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 74.9 tt0 -54.03 145.2 17.29 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.036 0.446 . . . . 0.0 111.363 -179.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.751 ' HG2' HG23 ' A' ' 8' ' ' ILE . 99.4 mtt180 -101.95 125.87 48.73 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.531 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.676 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.0 OUTLIER -114.6 146.88 40.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.33 -179.165 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -100.91 111.65 23.9 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.172 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.585 HD23 HG23 ' A' ' 41' ' ' VAL . 83.0 mt -76.32 143.73 40.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.758 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.529 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -111.46 -28.25 8.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.909 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -160.97 120.31 2.61 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.116 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.436 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 94.4 m-20 -109.17 5.2 23.69 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.942 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 t -69.62 -35.98 75.74 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.846 0.355 . . . . 0.0 111.427 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -83.23 157.4 22.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.668 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 90.5 m -56.83 -35.78 69.21 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 16.3 m95 -98.89 131.54 44.9 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.436 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 43.5 m0 -101.47 134.25 44.85 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.419 0.525 . . . . 0.0 112.419 -177.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.439 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 46.2 ttt85 -88.08 131.81 34.54 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.337 178.393 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.676 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -133.31 163.4 37.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.601 -178.522 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -126.77 140.9 52.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.367 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -108.82 162.99 13.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.823 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.73 -22.75 58.45 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.551 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.76 4.45 9.6 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.9 t30 74.31 24.17 1.91 Allowed 'General case' 0 C--N 1.342 0.258 0 C-N-CA 122.505 0.322 . . . . 0.0 110.952 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.653 ' CB ' HD21 ' A' ' 21' ' ' LEU . 95.4 mtt-85 -105.59 142.83 34.65 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.097 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 78.4 p -132.82 147.05 52.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.803 0.335 . . . . 0.0 111.277 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.476 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -170.31 176.83 43.83 Favored Glycine 0 CA--C 1.523 0.567 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.557 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.439 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 96.1 m-85 -103.13 99.39 9.26 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.075 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.739 HG22 ' HB2' ' A' ' 20' ' ' GLU . 19.8 t -108.1 111.83 61.78 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.294 179.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.86 32.93 0.33 Allowed 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.132 1.888 . . . . 0.0 112.448 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.45 ' O ' HG12 ' A' ' 56' ' ' VAL . 15.8 p -65.04 91.69 0.1 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.793 0.33 . . . . 0.0 111.344 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -72.6 -7.4 50.03 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.971 178.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.517 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.4 m-85 -66.81 -10.22 45.48 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.861 0.465 . . . . 0.0 112.231 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.622 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.5 p -115.49 143.63 24.92 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.122 0 CA-C-O 121.025 0.441 . . . . 0.0 110.805 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.28 157.24 46.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.528 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.761 ' HA ' HG12 ' A' ' 7' ' ' VAL . 73.8 ttp85 -79.73 132.08 36.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.95 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.3 mtmm . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.316 -0.849 . . . . 0.0 110.891 179.832 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.529 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 63.5 t . . . . . 0 CA--C 1.53 0.208 0 CA-C-O 120.732 0.301 . . . . 0.0 110.676 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.5 mt -104.07 121.0 55.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.286 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.605 HG12 ' HA ' ' A' ' 58' ' ' ARG . 22.2 m -132.55 162.35 39.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.809 0.338 . . . . 0.0 111.685 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.746 HG23 ' HG2' ' A' ' 28' ' ' ARG . 15.7 mt -123.62 120.61 60.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.85 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.506 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.6 129.24 37.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.643 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -95.32 -6.57 40.93 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.367 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.511 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.1 m-90 -147.34 142.25 26.91 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.848 0.356 . . . . 0.0 110.85 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.43 122.25 20.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.42 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.404 ' CE1' ' O ' ' A' ' 14' ' ' THR . 60.2 t80 -127.46 138.37 52.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.511 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.404 ' O ' ' CE1' ' A' ' 13' ' ' TYR . 27.2 m -98.37 139.63 33.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.9 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.757 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -53.45 128.02 27.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.754 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -61.46 -33.0 73.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.204 0.526 . . . . 0.0 110.426 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -135.76 162.0 33.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.699 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -59.17 -35.69 73.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.918 0.39 . . . . 0.0 111.659 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -66.06 -20.29 66.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.6 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.757 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.3 mm-40 -81.74 -179.83 7.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.948 0.404 . . . . 0.0 110.259 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.744 HD21 ' HB2' ' A' ' 43' ' ' ASN . 9.2 tp -120.21 145.59 46.85 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.681 -178.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -86.71 146.35 26.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.575 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.479 HG22 ' HG ' ' A' ' 29' ' ' LEU . 29.5 pt -131.13 164.29 34.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.106 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -121.59 168.9 11.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.233 0.539 . . . . 0.0 111.067 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.485 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 53.9 pttt -67.1 -15.27 63.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.386 -0.824 . . . . 0.0 113.162 -178.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -139.01 23.61 2.59 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.534 -0.466 . . . . 0.0 111.213 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -99.85 139.1 36.0 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.113 0.482 . . . . 0.0 110.641 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.746 ' HG2' HG23 ' A' ' 8' ' ' ILE . 60.6 mtt85 -92.65 121.43 34.07 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.76 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.507 HD22 ' C ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -113.92 150.07 34.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.875 0.369 . . . . 0.0 110.683 -179.607 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -102.71 113.53 27.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.404 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.529 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 61.0 mt -78.78 143.41 36.12 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.053 0.454 . . . . 0.0 111.28 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -107.82 -28.18 9.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.78 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -159.1 117.05 2.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.947 0.403 . . . . 0.0 110.889 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.448 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.9 p-10 -107.0 1.61 24.53 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.047 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.5 t -67.13 -37.76 84.39 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.88 0.371 . . . . 0.0 111.517 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -81.06 159.51 24.74 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.67 0.748 . . . . 0.0 112.779 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 16.9 p -56.96 -39.9 75.47 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.255 178.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -97.15 132.67 42.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.79 -1.095 . . . . 0.0 108.366 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.448 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 36.1 m0 -102.2 136.66 41.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -177.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 44.2 ttt180 -93.49 137.78 32.43 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 177.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.51 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -142.37 162.53 18.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.701 -0.4 . . . . 0.0 111.263 -178.316 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.43 ' HG3' HG22 ' A' ' 48' ' ' THR . 65.7 ttt180 -125.04 143.41 50.93 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.041 0.448 . . . . 0.0 111.891 -178.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.744 ' HB2' HD21 ' A' ' 21' ' ' LEU . 59.9 t30 -110.61 164.64 12.53 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.923 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.61 -22.97 64.34 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.804 178.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.97 5.33 11.91 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.043 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 67.82 26.56 7.63 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.95 0.405 . . . . 0.0 111.271 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.537 ' O ' HD13 ' A' ' 21' ' ' LEU . 27.1 ttm180 -110.4 127.65 55.19 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.43 HG22 ' HG3' ' A' ' 42' ' ' ARG . 37.3 p -122.72 152.62 40.4 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.832 0.349 . . . . 0.0 110.997 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.421 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -168.22 173.1 43.01 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.524 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -100.92 107.16 18.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.916 0.389 . . . . 0.0 111.17 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.724 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.3 t -119.75 113.91 34.39 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.058 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.08 42.81 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 121.804 1.669 . . . . 0.0 111.82 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.472 ' O ' HG12 ' A' ' 56' ' ' VAL . 2.8 p -70.62 88.45 0.69 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.096 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -66.54 -13.98 61.71 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.124 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.511 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.8 m-85 -61.67 -15.45 40.2 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.506 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.4 p -107.07 141.85 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 120.984 0.421 . . . . 0.0 110.451 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -127.44 151.35 48.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.768 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.605 ' HA ' HG12 ' A' ' 7' ' ' VAL . 76.4 mtp180 -69.57 139.9 53.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.836 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.537 ' HZ3' ' HB ' ' A' ' 8' ' ' ILE . 20.1 pttm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.909 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.448 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 77.9 t . . . . . 0 CA--C 1.528 0.121 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.5 mt -115.01 114.42 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.409 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.642 HG12 ' HA ' ' A' ' 58' ' ' ARG . 32.2 m -130.68 163.72 35.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.776 0.322 . . . . 0.0 111.55 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.598 ' C ' HG23 ' A' ' 56' ' ' VAL . 13.7 mt -121.94 121.93 65.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.413 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.601 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -78.45 120.26 22.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.677 -179.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -91.11 -7.71 50.88 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.562 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.642 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.8 m-90 -143.57 143.18 31.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.956 0.408 . . . . 0.0 110.705 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -72.08 120.47 17.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.129 0.49 . . . . 0.0 111.751 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.465 ' HB3' HD11 ' A' ' 23' ' ' ILE . 60.1 t80 -128.26 134.7 49.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.766 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.8 m -100.83 138.69 37.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.488 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.649 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -56.54 132.51 51.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.491 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.437 ' HB2' ' OE2' ' A' ' 20' ' ' GLU . 99.0 mm-40 -69.96 -16.06 63.14 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.998 179.191 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -141.64 172.89 12.06 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -74.38 -34.3 63.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.264 0.554 . . . . 0.0 110.533 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.77 -19.13 64.74 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.135 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.649 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -86.4 -179.85 6.74 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.635 -179.264 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.99 HD21 ' HB2' ' A' ' 43' ' ' ASN . 28.6 tp -122.1 130.72 53.5 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -177.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -71.23 142.24 50.58 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.194 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.465 HD11 ' HB3' ' A' ' 13' ' ' TYR . 38.1 pt -129.03 164.48 31.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.374 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 66.5 mttm -120.98 167.02 13.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.227 0.537 . . . . 0.0 111.366 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 56.2 pttt -66.84 -12.91 60.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.334 -0.848 . . . . 0.0 113.101 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -141.52 28.35 1.82 Allowed 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 72.5 tt0 -105.09 140.57 38.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.085 0.469 . . . . 0.0 110.928 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.488 ' C ' HD22 ' A' ' 29' ' ' LEU . 66.4 mtp180 -92.46 119.12 31.66 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.184 -179.564 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.551 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.5 mm? -112.23 150.91 30.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.511 -179.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -107.2 106.49 16.99 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.612 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.511 ' HA ' HG23 ' A' ' 41' ' ' VAL . 39.3 mt -76.06 149.67 37.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.44 0.638 . . . . 0.0 111.334 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -112.19 -30.43 7.21 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.643 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.1 m-20 -157.04 113.91 3.05 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.529 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.454 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -106.49 2.47 26.29 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -65.18 -37.9 88.8 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 120.843 0.354 . . . . 0.0 111.308 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -82.58 158.21 23.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.545 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -34.59 69.6 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.383 0.611 . . . . 0.0 109.383 178.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.475 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 37.4 m95 -96.21 129.84 43.42 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 114.985 -1.007 . . . . 0.0 108.703 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.454 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 38.6 m0 -104.11 132.53 50.27 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -177.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -90.03 131.06 36.11 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 177.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.647 HG13 HD23 ' A' ' 21' ' ' LEU . 0.7 OUTLIER -142.5 157.63 19.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.41 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.479 ' CB ' HG22 ' A' ' 48' ' ' THR . 36.5 ttp180 -123.59 141.85 51.61 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.707 -179.028 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.99 ' HB2' HD21 ' A' ' 21' ' ' LEU . 51.7 t30 -113.15 162.45 15.95 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.016 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.03 -18.91 15.85 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.882 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.71 5.27 11.56 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 67.39 26.05 8.49 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-O 120.852 0.358 . . . . 0.0 111.065 -179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -115.25 125.81 53.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.812 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.479 HG22 ' CB ' ' A' ' 42' ' ' ARG . 60.3 p -116.81 151.44 36.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.878 0.371 . . . . 0.0 111.032 -179.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.538 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.25 168.38 38.63 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.197 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -102.37 102.65 13.01 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.432 HG13 ' HB3' ' A' ' 20' ' ' GLU . 6.3 m -120.08 122.99 28.59 Favored Pre-proline 0 C--N 1.325 -0.479 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.729 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.475 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 84.2 Cg_endo -80.62 29.28 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.25 1.967 . . . . 0.0 112.333 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.407 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -58.66 91.89 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.3 -179.382 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -68.96 -12.7 61.9 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.059 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.642 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 99.1 m-85 -63.8 -13.79 47.31 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.424 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.601 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.2 p -113.39 142.4 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-O 121.023 0.44 . . . . 0.0 110.579 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -140.61 157.87 44.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.522 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.642 ' HA ' HG12 ' A' ' 7' ' ' VAL . 36.5 ttm180 -69.67 137.74 52.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.9 0.381 . . . . 0.0 110.804 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.4 tttt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.802 -179.78 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.7 t . . . . . 0 N--CA 1.456 -0.151 0 CA-C-O 120.899 0.381 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.5 mt -104.28 116.26 47.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.911 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 58' ' ' ARG . 26.4 m -130.83 163.07 37.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.983 0.42 . . . . 0.0 111.653 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.527 HD12 ' HD2' ' A' ' 59' ' ' LYS . 13.9 mt -123.65 133.49 69.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.019 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.433 ' HB1' HD12 ' A' ' 23' ' ' ILE . . . -80.33 137.01 36.51 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.675 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -102.74 7.45 39.66 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.696 ' CE3' ' HB2' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -163.06 151.18 13.78 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.805 0.336 . . . . 0.0 110.506 178.726 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.421 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 43.3 t0 -79.11 113.68 17.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.031 0.444 . . . . 0.0 111.91 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.492 ' HB2' ' CE2' ' A' ' 11' ' ' TRP . 56.4 t80 -127.57 145.79 50.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.16 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.9 t -105.75 135.22 47.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.373 178.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.722 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -52.75 139.24 27.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.476 . . . . 0.0 112.025 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -64.52 -31.34 72.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.071 0.463 . . . . 0.0 109.817 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -136.73 165.29 26.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.614 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -62.91 -27.89 69.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.861 0.362 . . . . 0.0 110.97 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -68.05 -26.21 65.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.14 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.722 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -89.08 176.92 6.79 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.595 ' O ' HG11 ' A' ' 51' ' ' VAL . 6.7 mp -128.01 141.55 51.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.999 0.428 . . . . 0.0 111.275 -179.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.0 p-10 -79.17 157.81 27.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.36 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.649 HG22 ' HG ' ' A' ' 29' ' ' LEU . 44.5 pt -127.93 155.48 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.028 179.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 95.4 mttt -111.25 172.45 6.87 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.845 0.355 . . . . 0.0 111.049 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.498 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 19.5 pttp -68.01 -12.96 61.77 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -178.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -151.97 29.38 0.58 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.477 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 59.2 tt0 -98.77 142.06 30.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.84 0.352 . . . . 0.0 110.961 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.507 ' C ' HD22 ' A' ' 29' ' ' LEU . 35.5 mtm-85 -92.3 121.59 33.95 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.404 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.649 ' HG ' HG22 ' A' ' 23' ' ' ILE . 0.6 OUTLIER -116.09 149.02 39.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.713 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -100.42 107.25 18.95 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.964 0.411 . . . . 0.0 110.743 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.576 HD21 ' HB3' ' A' ' 39' ' ' TRP . 0.1 OUTLIER -86.48 152.02 23.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.309 0.576 . . . . 0.0 112.444 -178.651 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.42 HD22 ' NH1' ' A' ' 40' ' ' ARG . 3.2 mp -114.0 -22.38 10.1 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.395 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -163.05 120.61 1.94 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.822 0.344 . . . . 0.0 110.815 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.506 ' HB3' HD22 ' A' ' 31' ' ' LEU . 30.1 p-10 -117.26 19.38 14.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.1 t -81.57 -34.99 30.71 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.741 0.305 . . . . 0.0 111.368 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.4 mmtm -86.87 160.9 18.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.925 0.393 . . . . 0.0 111.624 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 28.8 m -57.09 -33.98 67.85 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 121.352 0.596 . . . . 0.0 109.654 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.434 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 17.5 m95 -99.31 126.38 45.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.576 ' HB3' HD21 ' A' ' 31' ' ' LEU . 37.7 m0 -99.1 132.06 44.68 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.42 ' NH1' HD22 ' A' ' 32' ' ' LEU . 35.1 ttt180 -88.02 125.78 34.73 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.569 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.8 p -136.9 162.12 34.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -177.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.472 ' HG3' HG22 ' A' ' 48' ' ' THR . 79.1 ttt180 -130.38 148.44 52.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.15 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -117.0 171.52 7.86 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.135 0.493 . . . . 0.0 112.034 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.2 -18.21 60.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.869 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.81 6.47 10.91 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 67.63 24.1 8.59 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 120.899 0.381 . . . . 0.0 111.14 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.578 ' O ' HD21 ' A' ' 21' ' ' LEU . 99.4 mtt180 -111.03 128.37 55.84 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.861 178.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.472 HG22 ' HG3' ' A' ' 42' ' ' ARG . 16.5 p -113.66 159.11 20.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.513 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.506 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -175.1 176.75 47.21 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.18 -1.009 . . . . 0.0 113.347 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 65.2 m-85 -115.99 110.51 19.04 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.595 HG11 ' O ' ' A' ' 21' ' ' LEU . 0.3 OUTLIER -122.99 127.68 25.61 Favored Pre-proline 0 CA--C 1.532 0.251 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.618 178.308 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.434 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 76.7 Cg_endo -76.43 58.6 5.84 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.114 1.876 . . . . 0.0 111.765 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.3 p -66.97 94.36 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -60.42 -60.55 3.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.05 0.452 . . . . 0.0 109.951 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.696 ' HB2' ' CE3' ' A' ' 11' ' ' TRP . 19.5 m-85 -84.35 97.39 9.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 122.582 1.182 . . . . 0.0 113.431 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.1 p -155.45 140.84 10.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.698 177.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -121.43 134.7 55.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.832 0.349 . . . . 0.0 111.679 -178.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.435 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 67.9 ttp85 -78.56 133.42 37.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.867 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.527 ' HD2' HD12 ' A' ' 8' ' ' ILE . 22.1 mttm . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.007 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 30' ' ' TRP . 57.3 t . . . . . 0 N--CA 1.455 -0.187 0 N-CA-C 110.482 -0.192 . . . . 0.0 110.482 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 8.2 mt -106.14 116.71 50.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.766 0.317 . . . . 0.0 111.297 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.528 HG12 ' CB ' ' A' ' 58' ' ' ARG . 34.8 m -131.33 161.21 41.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.215 179.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.583 HG23 ' HG2' ' A' ' 28' ' ' ARG . 18.9 mt -122.41 126.3 73.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.78 179.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.624 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.77 144.94 41.13 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.941 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -110.14 -25.68 10.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.335 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.491 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 8.3 m-90 -133.36 137.63 45.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -61.98 122.05 14.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.621 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.446 ' HB3' HD11 ' A' ' 23' ' ' ILE . 53.2 t80 -127.09 137.35 53.0 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.648 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.7 m -105.94 137.67 43.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.553 179.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.735 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -53.4 142.58 21.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.218 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -88.24 -8.31 55.46 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.272 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -149.12 167.54 25.65 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.646 0.26 . . . . 0.0 110.508 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -68.14 -29.27 68.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.335 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -77.22 -11.33 59.81 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.863 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.735 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -89.69 179.26 6.06 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.86 HD21 ' HB2' ' A' ' 43' ' ' ASN . 44.0 tp -121.7 134.63 54.96 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.026 0.441 . . . . 0.0 111.71 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -77.11 144.47 38.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.853 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.446 HD11 ' HB3' ' A' ' 13' ' ' TYR . 23.1 pt -131.83 164.66 34.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.109 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -113.13 -177.03 3.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.952 0.406 . . . . 0.0 111.284 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -64.91 -51.49 61.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.586 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -109.83 -5.6 15.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -57.05 144.63 33.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.813 0.34 . . . . 0.0 111.25 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.583 ' HG2' HG23 ' A' ' 8' ' ' ILE . 81.8 mtm180 -97.63 124.35 41.88 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.63 179.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.655 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.8 mm? -111.59 147.13 36.12 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.895 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.41 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 6.2 m-90 -104.33 104.24 14.1 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.144 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.915 HD11 ' HB3' ' A' ' 39' ' ' TRP . 0.5 OUTLIER -72.23 147.63 46.3 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.3 0.572 . . . . 0.0 112.259 -179.057 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.2 mp -109.82 -26.68 9.68 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.976 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -160.99 118.16 2.33 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.808 0.337 . . . . 0.0 111.257 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.44 ' OD2' ' HG ' ' A' ' 31' ' ' LEU . 97.0 m-20 -105.61 3.62 29.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.159 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 57.7 m -68.57 -35.36 77.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.708 0.289 . . . . 0.0 111.721 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -85.68 156.48 20.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.257 0.551 . . . . 0.0 112.264 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 58.6 m -57.72 -31.8 66.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.188 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.485 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 7.4 m0 -100.26 132.99 45.32 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.915 ' HB3' HD11 ' A' ' 31' ' ' LEU . 23.5 m0 -100.69 128.97 46.55 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -176.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.805 ' O ' HD13 ' A' ' 31' ' ' LEU . 72.6 ttt180 -87.94 122.82 32.01 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.812 HG13 HD23 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -138.45 151.09 24.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 120.475 -0.49 . . . . 0.0 112.219 -177.835 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.451 ' CB ' ' HB ' ' A' ' 48' ' ' THR . 24.4 ttp-105 -121.92 146.72 46.85 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.3 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.86 ' HB2' HD21 ' A' ' 21' ' ' LEU . 57.6 t30 -116.05 164.6 14.22 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.363 -179.275 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.38 -18.26 16.72 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.867 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.89 4.78 11.11 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.3 t30 72.64 21.59 3.48 Favored 'General case' 0 C--N 1.339 0.116 0 CA-C-O 120.859 0.361 . . . . 0.0 111.302 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.457 ' O ' HD13 ' A' ' 21' ' ' LEU . 95.6 mtt180 -114.8 130.49 56.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.905 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.451 ' HB ' ' CB ' ' A' ' 42' ' ' ARG . 12.2 t -141.34 143.17 33.87 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.778 -179.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.455 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.47 178.64 39.64 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.371 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.4 m-85 -93.38 113.17 25.28 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.632 0.253 . . . . 0.0 111.512 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.516 HG13 ' HB3' ' A' ' 20' ' ' GLU . 4.6 m -127.46 120.94 22.21 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.846 -0.161 . . . . 0.0 111.263 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.485 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 6.3 Cg_exo -72.33 30.92 0.27 Allowed 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.421 2.081 . . . . 0.0 112.091 177.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.456 ' O ' HG12 ' A' ' 56' ' ' VAL . 8.4 t -66.0 85.51 0.09 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 120.897 0.379 . . . . 0.0 111.135 -179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 p30 -69.09 -9.97 55.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.422 178.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.491 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 80.9 m-85 -65.2 -10.63 33.03 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.624 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.6 p -115.03 141.48 31.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.909 0.385 . . . . 0.0 110.735 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -137.73 150.4 47.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.725 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.528 ' CB ' HG12 ' A' ' 7' ' ' VAL . 67.7 ttt180 -69.53 140.5 53.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.802 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 93.2 mttt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.243 -0.884 . . . . 0.0 111.051 179.968 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.424 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 59.3 t . . . . . 0 N--CA 1.452 -0.325 0 CA-C-O 120.761 0.315 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.1 mt -114.06 118.38 58.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.117 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.735 HG12 ' HA ' ' A' ' 58' ' ' ARG . 32.9 m -131.39 162.53 39.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 121.048 0.452 . . . . 0.0 111.623 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.642 HG23 ' HG2' ' A' ' 28' ' ' ARG . 10.5 mt -120.02 123.6 71.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.503 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.657 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.5 126.5 31.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.202 -179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -96.47 -10.35 27.65 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.336 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.63 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.6 m-90 -145.12 143.14 30.22 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.792 0.329 . . . . 0.0 110.577 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -67.8 125.51 26.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.096 0.474 . . . . 0.0 111.62 -178.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.467 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 58.2 t80 -127.8 138.12 52.62 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.844 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.7 t -102.74 140.28 37.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.913 0.387 . . . . 0.0 110.714 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.631 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -61.45 136.24 57.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.474 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -84.39 -3.58 58.39 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.085 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.472 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 92.8 mt-30 -145.47 171.65 14.33 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.586 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -76.44 -29.84 57.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.935 0.398 . . . . 0.0 111.283 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -75.99 -12.65 60.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.937 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.631 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -88.74 178.02 6.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.933 0.397 . . . . 0.0 110.726 -179.697 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.615 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.5 mp -124.88 139.52 53.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.77 -178.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -78.6 146.41 34.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.354 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.467 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 45.8 pt -129.84 161.87 38.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.473 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -114.72 166.32 11.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.768 0.318 . . . . 0.0 111.025 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.463 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 21.0 pttp -63.75 -11.32 25.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -138.45 25.95 2.62 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.289 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.439 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 83.9 tt0 -99.57 138.01 37.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.854 0.359 . . . . 0.0 110.903 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.642 ' HG2' HG23 ' A' ' 8' ' ' ILE . 75.8 mtp180 -94.1 120.67 34.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.124 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.601 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -115.21 150.06 36.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.04 -179.351 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.0 m-90 -103.43 107.15 17.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.172 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.459 ' HA ' HG23 ' A' ' 41' ' ' VAL . 89.3 mt -76.69 149.15 36.44 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.051 0.453 . . . . 0.0 111.561 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.0 mp -113.97 -28.63 7.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.036 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -160.99 118.88 2.4 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.552 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.444 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 31.3 p-10 -110.87 2.8 18.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.128 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.0 m -65.06 -36.82 85.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.828 0.347 . . . . 0.0 111.342 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -83.63 158.75 21.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.083 0.468 . . . . 0.0 111.809 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.7 m -57.44 -34.78 69.32 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.564 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 61.3 m95 -97.64 131.61 44.06 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 177.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.479 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 40.5 m0 -103.94 133.79 48.31 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -177.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.422 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 37.4 ttt180 -88.58 130.1 35.33 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.601 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.7 OUTLIER -141.04 155.52 21.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 120.915 0.388 . . . . 0.0 111.589 -178.702 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.458 ' HB2' HG22 ' A' ' 48' ' ' THR . 40.3 ttp180 -120.42 145.58 47.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.605 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -113.04 162.56 15.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.703 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.16 -21.33 46.7 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.879 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.34 5.23 10.96 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.857 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.0 t30 72.81 24.68 2.63 Favored 'General case' 0 N--CA 1.46 0.071 0 CA-C-O 120.829 0.347 . . . . 0.0 110.895 -179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.491 ' O ' HD21 ' A' ' 21' ' ' LEU . 82.5 mtm180 -108.92 136.89 47.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.434 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.458 HG22 ' HB2' ' A' ' 42' ' ' ARG . 74.8 p -124.81 152.7 43.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.729 0.299 . . . . 0.0 110.905 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -174.23 179.87 45.3 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.56 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.479 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 95.3 m-85 -110.11 113.54 26.32 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.808 0.304 . . . . 0.0 111.618 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.615 HG11 ' O ' ' A' ' 21' ' ' LEU . 29.4 m -131.21 112.02 15.59 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.587 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.564 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 74.0 Cg_endo -74.73 45.24 1.25 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.18 1.92 . . . . 0.0 111.855 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.717 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.4 p -69.61 73.63 0.38 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.038 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -53.57 -19.18 3.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.935 0.398 . . . . 0.0 110.93 178.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.63 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 77.5 m-85 -61.11 -12.83 13.66 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.221 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.717 HG12 ' O ' ' A' ' 53' ' ' SER . 11.9 p -110.36 146.15 15.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-O 120.808 0.337 . . . . 0.0 110.943 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.419 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 85.5 tt0 -142.21 164.17 30.88 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.544 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.735 ' HA ' HG12 ' A' ' 7' ' ' VAL . 18.8 mtp180 -68.69 139.28 55.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.528 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.6 tttp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.343 -0.836 . . . . 0.0 110.864 179.938 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.456 ' HB ' ' HB3' ' A' ' 31' ' ' LEU . 64.1 t . . . . . 0 CA--C 1.531 0.244 0 CA-C-O 120.726 0.298 . . . . 0.0 110.382 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.3 mm -100.41 110.97 28.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.807 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.754 HG12 ' HA ' ' A' ' 58' ' ' ARG . 34.6 m -128.49 155.91 40.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.767 0.318 . . . . 0.0 111.348 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.57 HD12 ' HG2' ' A' ' 28' ' ' ARG . 30.6 mm -121.29 126.98 75.68 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.874 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.564 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.96 143.14 45.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.496 -179.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.429 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 60.3 mttp -112.42 -24.34 9.8 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.753 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.6 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.3 m-90 -137.1 136.7 38.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.045 0.45 . . . . 0.0 110.552 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -59.74 120.8 10.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.394 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.516 ' HB3' HD11 ' A' ' 23' ' ' ILE . 49.3 t80 -127.22 138.39 53.1 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.144 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 86.6 m -107.06 139.64 41.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.657 179.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.574 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.22 135.54 56.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.713 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -87.75 0.32 55.9 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.542 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.467 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 95.8 mt-30 -147.11 167.23 24.63 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -75.05 -20.28 59.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.577 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -88.47 -8.19 55.32 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.574 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -88.54 177.53 6.76 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.658 -179.757 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.947 HD23 HG13 ' A' ' 41' ' ' VAL . 38.6 tp -119.44 128.66 54.23 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -70.4 141.69 52.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.9 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.516 HD11 ' HB3' ' A' ' 13' ' ' TYR . 35.9 pt -130.65 162.59 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.253 179.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 88.3 mttt -110.95 -177.27 3.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.901 0.381 . . . . 0.0 110.767 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HG3' ' HA ' ' A' ' 11' ' ' TRP . 27.6 ttpp -65.3 -48.76 72.01 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.626 -178.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -114.61 -0.25 13.71 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.443 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 66.3 tt0 -57.62 144.11 38.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.105 0.479 . . . . 0.0 111.175 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.57 ' HG2' HD12 ' A' ' 8' ' ' ILE . 89.1 mtt180 -91.49 121.67 33.39 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.467 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.726 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.7 mm? -115.28 140.65 48.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.344 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -100.89 105.26 16.51 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.793 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.672 HD11 ' HB3' ' A' ' 39' ' ' TRP . 5.6 tp -84.1 151.34 24.99 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 mp -107.92 -19.32 13.56 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.757 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -168.82 125.12 0.95 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.787 0.327 . . . . 0.0 111.326 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.418 ' HB3' HD23 ' A' ' 31' ' ' LEU . 34.1 p-10 -115.58 2.18 13.73 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.682 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.2 m -64.13 -38.33 90.65 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.791 0.329 . . . . 0.0 111.623 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -82.9 159.01 22.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.002 0.429 . . . . 0.0 111.746 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.8 m -58.94 -35.58 73.36 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.476 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 22.6 m95 -94.59 127.67 40.69 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.672 ' HB3' HD11 ' A' ' 31' ' ' LEU . 41.5 m0 -102.06 134.45 45.27 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -177.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.454 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 53.6 ttt180 -92.38 125.81 37.19 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.931 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.947 HG13 HD23 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -139.2 161.79 28.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -178.514 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.637 ' CB ' HG22 ' A' ' 48' ' ' THR . 53.7 ttp180 -125.81 147.58 49.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.042 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.922 ' HB3' HD21 ' A' ' 21' ' ' LEU . 47.3 p-10 -118.6 172.25 7.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.012 0.434 . . . . 0.0 111.762 -179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.37 -23.43 65.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.541 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.36 4.97 9.57 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 68.98 25.68 5.89 Favored 'General case' 0 N--CA 1.457 -0.093 0 CA-C-O 120.815 0.34 . . . . 0.0 111.012 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 55.3 mtp180 -111.09 132.46 54.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.692 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.637 HG22 ' CB ' ' A' ' 42' ' ' ARG . 80.6 p -123.49 148.28 46.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.923 -179.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.454 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.2 168.69 40.58 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.39 -0.909 . . . . 0.0 113.142 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.454 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 96.9 m-85 -101.14 103.91 14.98 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 20' ' ' GLU . 4.7 m -117.4 119.93 33.91 Favored Pre-proline 0 C--N 1.33 -0.26 0 C-N-CA 121.214 -0.194 . . . . 0.0 111.385 178.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.476 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 72.6 Cg_endo -74.84 41.63 0.75 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.356 2.038 . . . . 0.0 111.6 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.471 ' O ' HG12 ' A' ' 56' ' ' VAL . 80.2 p -71.07 89.93 0.83 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.586 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -66.44 -13.23 60.48 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.589 -0.445 . . . . 0.0 110.166 178.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.6 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.5 m-85 -64.11 -12.96 44.29 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.564 HG23 ' HA ' ' A' ' 9' ' ' ALA . 9.4 p -114.6 140.9 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 121.129 0.49 . . . . 0.0 110.848 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -133.78 163.25 29.89 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.418 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.754 ' HA ' HG12 ' A' ' 7' ' ' VAL . 71.6 ttt-85 -80.21 135.74 36.33 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.47 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.684 179.786 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.463 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.7 t . . . . . 0 CA--C 1.531 0.214 0 CA-C-O 120.796 0.331 . . . . 0.0 110.402 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -98.67 112.32 30.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.352 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.762 HG12 ' CA ' ' A' ' 58' ' ' ARG . 35.4 m -131.58 162.28 39.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.045 0.45 . . . . 0.0 111.835 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.59 ' C ' HG23 ' A' ' 56' ' ' VAL . 33.5 mt -120.18 124.58 72.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.851 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.613 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.61 120.43 20.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.061 0.458 . . . . 0.0 111.481 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -92.96 -9.49 39.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.842 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.645 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.3 m-90 -141.86 142.24 33.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.87 0.366 . . . . 0.0 110.85 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -72.43 123.15 22.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.462 -179.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.445 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 57.8 t80 -127.53 137.77 52.72 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.53 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.01 135.13 41.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.941 ' HB1' ' HG3' ' A' ' 20' ' ' GLU . . . -61.91 136.84 58.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.032 0.444 . . . . 0.0 111.795 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -86.53 0.14 54.91 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.313 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.474 ' HB2' ' HG2' ' A' ' 20' ' ' GLU . 96.7 mt-30 -153.69 162.0 41.64 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.914 0.387 . . . . 0.0 110.992 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -64.75 -40.21 94.93 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.242 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -61.01 -31.3 70.92 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.918 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.941 ' HG3' ' HB1' ' A' ' 15' ' ' ALA . 6.1 pt-20 -86.47 175.5 8.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.12 -179.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.714 ' O ' HG11 ' A' ' 51' ' ' VAL . 10.6 mp -128.88 158.88 37.52 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -176.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -86.97 149.67 24.61 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.884 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.611 HG22 HD11 ' A' ' 29' ' ' LEU . 47.6 pt -130.68 161.05 41.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.798 178.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 64.6 mttm -115.9 166.54 11.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.253 0.549 . . . . 0.0 111.437 -179.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 54.9 pttt -66.37 -11.24 50.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.781 -179.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -140.54 25.35 2.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.406 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 82.3 tt0 -100.94 140.0 35.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.101 0.477 . . . . 0.0 110.69 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 -91.69 119.57 31.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.824 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.636 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.2 mm? -110.55 143.59 40.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.419 -178.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 29.4 m-90 -98.78 106.01 18.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.985 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.463 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 73.0 mt -75.64 148.77 38.48 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.489 0.662 . . . . 0.0 111.823 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.596 HD23 ' HA ' ' A' ' 41' ' ' VAL . 3.6 mm? -115.27 -35.52 4.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.896 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -160.68 116.96 2.31 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.753 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.444 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -109.99 3.81 20.79 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.0 t -66.63 -39.24 88.19 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.799 0.333 . . . . 0.0 111.289 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -82.66 159.15 22.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.641 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.0 -34.75 68.46 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 121.417 0.627 . . . . 0.0 109.38 178.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.467 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 63.4 m95 -96.18 130.03 43.34 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.458 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 39.6 m0 -104.4 127.3 52.06 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.44 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 66.8 ttt180 -84.9 126.88 33.86 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.636 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -134.69 161.92 39.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.102 0.477 . . . . 0.0 111.87 -178.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.413 ' CB ' HG22 ' A' ' 48' ' ' THR . 41.6 ttm180 -123.66 151.31 43.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.891 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.401 ' OD1' HD13 ' A' ' 29' ' ' LEU . 34.0 m-20 -119.68 168.57 10.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.813 0.34 . . . . 0.0 111.246 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.19 67.73 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.382 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.86 4.56 9.52 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.1 t30 72.44 24.06 3.02 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.819 0.343 . . . . 0.0 111.093 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.48 ' CB ' HD21 ' A' ' 21' ' ' LEU . 81.2 mtp180 -106.09 135.5 47.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.413 HG22 ' CB ' ' A' ' 42' ' ' ARG . 77.0 p -124.66 157.58 35.21 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.21 -179.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.687 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -174.02 174.27 46.25 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 120.303 -0.951 . . . . 0.0 113.105 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.458 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 84.7 m-85 -107.2 97.0 6.82 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -178.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.815 HG13 ' HB2' ' A' ' 20' ' ' GLU . 0.8 OUTLIER -115.26 116.91 41.66 Favored Pre-proline 0 N--CA 1.469 0.51 0 CA-C-O 119.622 -0.228 . . . . 0.0 111.361 177.839 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.467 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 73.9 Cg_endo -76.63 44.4 1.4 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.243 1.962 . . . . 0.0 111.464 177.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.52 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.8 OUTLIER -70.26 80.08 0.53 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -59.49 -17.28 30.37 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.554 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.645 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 85.7 m-85 -59.82 -12.51 7.57 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.613 HG23 ' HA ' ' A' ' 9' ' ' ALA . 8.6 p -109.6 143.73 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 120.939 0.399 . . . . 0.0 110.96 179.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 55.6 mp0 -143.38 161.22 38.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.583 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.762 ' CA ' HG12 ' A' ' 7' ' ' VAL . 77.8 ttt180 -71.01 140.51 50.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.125 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.4 tttt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.753 179.312 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 30' ' ' TRP . 93.2 t . . . . . 0 C--O 1.223 -0.298 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.423 HG12 ' CD1' ' A' ' 30' ' ' TRP . 41.5 mt -114.49 115.88 50.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.771 0.32 . . . . 0.0 110.847 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.669 HG12 ' CA ' ' A' ' 58' ' ' ARG . 34.9 m -130.77 159.68 42.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.129 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.625 HD12 ' HG2' ' A' ' 28' ' ' ARG . 16.4 mm -114.93 125.71 72.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.59 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.526 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.05 145.17 42.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.802 0.334 . . . . 0.0 110.862 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -112.75 -23.7 10.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.477 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.58 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.8 m-90 -134.21 139.76 46.02 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.975 0.417 . . . . 0.0 110.593 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -66.68 121.22 14.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.282 -178.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.442 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 47.3 t80 -126.25 136.56 52.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.694 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.5 m -103.34 145.56 29.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.841 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.773 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.28 138.92 54.18 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.276 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -84.54 -9.3 58.45 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.975 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.438 ' HB2' ' HG2' ' A' ' 20' ' ' GLU . 74.9 mt-30 -150.75 168.78 23.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -67.08 -34.0 76.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.893 0.378 . . . . 0.0 111.64 -179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -77.66 -6.03 52.45 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.019 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.773 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -87.74 179.04 6.57 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.801 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.959 HD23 HG13 ' A' ' 41' ' ' VAL . 43.7 tp -121.32 119.12 31.27 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -68.32 141.47 55.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.266 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.472 HG22 HD11 ' A' ' 29' ' ' LEU . 14.9 pt -128.14 165.52 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.981 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 60.2 mttt -114.09 -179.12 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.215 0.531 . . . . 0.0 111.057 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.429 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 36.5 ttpt -64.53 -48.14 76.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.804 -178.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -113.09 2.57 15.74 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.482 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 71.3 tt0 -60.53 148.19 38.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.122 0.487 . . . . 0.0 111.363 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.625 ' HG2' HD12 ' A' ' 8' ' ' ILE . 84.6 mtm180 -94.54 121.32 35.96 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.946 179.46 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.673 ' HB3' HG21 ' A' ' 41' ' ' VAL . 3.6 mm? -114.58 137.79 51.45 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.489 ' C ' HG23 ' A' ' 41' ' ' VAL . 6.3 m0 -101.3 106.01 17.15 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.982 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.446 HD11 ' CZ3' ' A' ' 39' ' ' TRP . 81.3 mt -78.58 154.53 30.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.488 0.661 . . . . 0.0 111.94 -179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.0 mp -117.09 -29.19 6.01 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.808 179.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -158.98 116.65 2.82 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.203 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.489 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 40.2 p-10 -111.14 10.45 21.91 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.5 t -74.2 -35.24 63.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.878 0.371 . . . . 0.0 111.432 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmtp -84.4 159.62 20.79 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.794 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 87.9 m -59.27 -32.97 70.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.422 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.451 ' CD1' ' N ' ' A' ' 38' ' ' TRP . 2.8 m95 -96.74 130.95 43.89 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.489 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 32.5 m0 -103.36 135.85 44.22 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -177.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.442 ' HG2' HD13 ' A' ' 32' ' ' LEU . 28.3 ttm180 -96.7 127.86 43.09 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.959 HG13 HD23 ' A' ' 21' ' ' LEU . 3.8 p -143.55 156.62 16.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.962 -177.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -122.84 143.18 50.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.049 0.452 . . . . 0.0 111.68 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.548 ' CG ' HD21 ' A' ' 21' ' ' LEU . 43.0 m-20 -107.37 161.67 14.6 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.236 179.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.98 -24.28 64.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.197 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.67 2.64 11.46 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.357 -0.383 . . . . 0.0 112.032 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.2 t30 73.93 24.38 2.07 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.678 0.275 . . . . 0.0 111.042 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -109.39 129.71 55.53 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.308 -0.406 . . . . 0.0 109.956 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.1 p -125.15 161.58 26.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.694 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 178.6 169.73 39.71 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.997 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -97.49 108.76 21.54 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.788 0.328 . . . . 0.0 111.689 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.559 HG13 ' HB3' ' A' ' 20' ' ' GLU . 9.6 m -132.3 114.17 14.69 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.64 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -70.77 44.5 0.51 Allowed 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 121.858 1.706 . . . . 0.0 111.761 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.525 ' O ' HG12 ' A' ' 56' ' ' VAL . 85.6 p -70.57 76.91 0.58 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 121.045 0.45 . . . . 0.0 110.506 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -60.14 -17.97 44.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.638 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.58 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 83.0 m-85 -58.86 -15.5 12.87 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.593 HG23 ' C ' ' A' ' 8' ' ' ILE . 4.5 p -112.95 141.12 29.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-O 121.001 0.429 . . . . 0.0 110.676 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -142.96 162.57 35.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.088 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.669 ' CA ' HG12 ' A' ' 7' ' ' VAL . 29.5 ttm180 -70.96 140.59 50.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.772 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.965 -179.907 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.4 t . . . . . 0 C--O 1.225 -0.229 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.4 mt -104.15 112.97 39.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.438 0.161 . . . . 0.0 111.312 -179.805 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.695 HG12 ' CA ' ' A' ' 58' ' ' ARG . 32.1 m -128.15 162.72 33.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 120.794 0.331 . . . . 0.0 111.469 179.315 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.725 HD12 ' HG2' ' A' ' 28' ' ' ARG . 19.3 mm -120.01 120.07 62.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.586 -179.382 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.429 ' N ' HG23 ' A' ' 56' ' ' VAL . . . -76.4 119.65 20.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.745 179.664 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -92.48 -8.37 44.79 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.037 -179.759 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.444 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 7.3 m-90 -142.49 142.4 32.27 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.789 0.328 . . . . 0.0 110.859 -179.594 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -71.56 122.59 20.76 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.046 0.45 . . . . 0.0 110.95 -178.916 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.45 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 58.4 t80 -127.8 137.08 52.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.943 -179.908 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.6 m -103.77 139.06 39.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.653 179.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.71 136.73 50.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.575 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -91.18 1.51 57.04 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.441 178.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.514 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 99.3 mt-30 -142.74 166.23 25.23 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.219 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -75.82 -20.9 57.81 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.136 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -90.16 -5.51 56.37 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -179.486 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.558 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -87.25 -179.46 6.42 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.051 0.453 . . . . 0.0 111.499 -179.565 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.957 HD21 ' HB2' ' A' ' 43' ' ' ASN . 14.2 tp -124.1 130.67 52.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.526 -178.069 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -72.82 147.54 45.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.467 179.303 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.558 HG22 HD11 ' A' ' 29' ' ' LEU . 37.2 pt -132.2 164.3 35.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.647 179.503 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 59.9 mttt -118.06 167.09 11.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.158 0.504 . . . . 0.0 110.975 179.808 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 52.6 pttt -66.45 -11.52 52.41 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.931 -179.575 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -141.78 27.73 1.82 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.965 0.412 . . . . 0.0 110.903 179.542 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.511 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 82.0 tt0 -99.69 140.7 33.5 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.208 0.528 . . . . 0.0 111.04 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.725 ' HG2' HD12 ' A' ' 8' ' ' ILE . 76.2 mtm180 -89.16 119.28 29.52 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.712 -179.928 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.733 ' HB3' HG21 ' A' ' 41' ' ' VAL . 3.0 mm? -115.23 139.9 49.55 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.806 -178.165 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.56 ' C ' HG23 ' A' ' 41' ' ' VAL . 5.5 m-90 -103.83 104.42 14.42 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.308 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.468 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 33.6 mt -77.56 142.22 39.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.259 0.552 . . . . 0.0 112.05 -178.932 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -105.02 -26.7 12.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.04 -179.899 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -159.03 115.12 2.62 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.803 0.335 . . . . 0.0 110.788 179.739 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.422 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 88.6 m-20 -108.18 4.67 25.06 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.061 -179.746 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.4 p -71.19 -34.32 70.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.967 0.413 . . . . 0.0 111.026 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -83.78 158.14 21.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.716 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 81.3 m -59.32 -33.04 70.64 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.195 178.285 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.447 ' N ' ' CD1' ' A' ' 38' ' ' TRP . 5.5 m95 -98.74 131.7 44.68 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 177.554 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 35.9 m0 -103.87 130.94 51.5 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -177.404 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.447 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 39.6 ttt85 -88.09 136.4 32.99 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 177.601 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.733 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.4 p -150.36 155.17 7.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.831 -178.879 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.508 ' HG3' HG22 ' A' ' 48' ' ' THR . 48.4 ttp180 -121.4 144.2 48.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.075 -179.709 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.957 ' HB2' HD21 ' A' ' 21' ' ' LEU . 43.8 t-20 -110.41 164.45 12.68 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.062 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.13 -25.4 65.45 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.256 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.26 3.72 8.36 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 179.382 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 73.96 24.36 2.06 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 120.749 0.309 . . . . 0.0 110.819 -179.621 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.4 mtm180 -108.05 131.56 54.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.069 179.52 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.508 HG22 ' HG3' ' A' ' 42' ' ' ARG . 30.6 p -126.34 147.86 49.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.144 -179.472 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.458 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.22 167.3 39.77 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.806 179.861 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.447 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.2 m-85 -99.63 106.44 18.39 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 117.082 0.441 . . . . 0.0 112.182 -179.23 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.525 HG13 ' HB3' ' A' ' 20' ' ' GLU . 14.0 m -124.94 114.47 26.54 Favored Pre-proline 0 CA--C 1.534 0.342 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 179.19 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.98 35.4 0.27 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 122.027 1.818 . . . . 0.0 112.211 177.698 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.472 ' O ' HG12 ' A' ' 56' ' ' VAL . 7.5 t -67.93 81.46 0.21 Allowed 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 120.861 0.362 . . . . 0.0 110.426 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -57.11 -19.12 17.9 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.146 0.498 . . . . 0.0 110.626 178.375 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.434 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 91.8 m-85 -54.58 -16.52 2.47 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.728 179.447 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.599 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.6 p -115.69 140.49 37.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 120.958 0.408 . . . . 0.0 111.147 179.826 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -145.54 161.91 38.67 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.891 -179.909 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.695 ' CA ' HG12 ' A' ' 7' ' ' VAL . 67.5 ttp85 -72.48 142.15 48.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.902 179.805 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 94.3 mttt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.671 179.443 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.506 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 60.4 t . . . . . 0 N--CA 1.455 -0.217 0 CA-C-O 120.741 0.305 . . . . 0.0 110.733 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.473 HG12 ' HD1' ' A' ' 30' ' ' TRP . 24.6 mt -102.6 120.61 52.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.08 -179.98 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.676 HG12 ' HB3' ' A' ' 58' ' ' ARG . 27.2 m -129.62 164.98 30.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.164 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.625 ' C ' HG23 ' A' ' 56' ' ' VAL . 26.2 mt -123.14 123.8 68.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.687 179.545 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.483 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.9 120.51 21.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.346 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -90.04 -7.21 54.45 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.814 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.548 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 5.3 m-90 -144.48 143.25 30.78 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.819 0.343 . . . . 0.0 111.342 -179.604 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -70.45 121.58 18.03 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.548 179.952 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.47 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 63.6 t80 -127.66 140.13 52.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.966 0.412 . . . . 0.0 111.397 -179.476 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 75.0 m -102.21 137.97 39.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.683 179.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.583 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.8 139.23 54.5 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.488 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -89.93 -0.01 57.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.299 179.1 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.496 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 94.2 mt-30 -147.23 163.85 35.05 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 179.225 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -70.59 -24.72 62.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 111.814 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -82.91 -15.51 51.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.271 -0.422 . . . . 0.0 112.115 -179.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.583 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -85.88 177.53 7.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.097 0.475 . . . . 0.0 110.431 179.749 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.654 ' O ' HG21 ' A' ' 51' ' ' VAL . 8.2 mp -129.43 142.41 50.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.489 -179.471 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -77.92 155.67 30.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.803 179.914 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.47 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 50.6 pt -133.55 165.02 33.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.478 179.59 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 40.0 mttp -115.76 165.73 12.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.062 0.458 . . . . 0.0 111.146 -179.652 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.548 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 22.4 pttp -64.97 -14.14 59.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.629 -179.328 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -138.92 25.72 2.51 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.189 179.738 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 80.8 tt0 -100.77 138.54 37.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.104 0.478 . . . . 0.0 110.967 -179.95 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.519 ' C ' HD22 ' A' ' 29' ' ' LEU . 82.6 mtm180 -94.1 123.17 37.3 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.927 -179.853 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.692 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -115.72 150.2 37.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.889 0.376 . . . . 0.0 111.1 -179.668 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.473 ' HD1' HG12 ' A' ' 6' ' ' ILE . 7.5 m-90 -101.38 111.73 24.04 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.267 179.917 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.506 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 72.0 mt -74.84 148.56 40.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.945 0.402 . . . . 0.0 111.416 -179.794 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.4 mp -111.31 -27.22 8.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.67 179.454 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -161.87 118.38 2.09 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.595 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.457 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 35.0 p-10 -110.02 6.76 23.29 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.655 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.0 p -71.87 -35.5 69.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.957 0.408 . . . . 0.0 111.212 -179.715 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -83.63 157.56 22.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.715 -179.491 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.8 m -57.32 -35.52 69.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.199 178.315 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -97.5 128.54 44.34 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.6 177.854 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.457 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 42.2 m0 -99.03 140.23 33.5 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -177.903 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.545 ' HG2' HD13 ' A' ' 32' ' ' LEU . 47.8 ttt180 -99.56 134.47 42.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.075 -0.966 . . . . 0.0 108.778 178.081 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.692 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.5 OUTLIER -136.53 161.92 36.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.924 0.392 . . . . 0.0 111.8 -178.455 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.463 ' HB2' HG22 ' A' ' 48' ' ' THR . 37.9 ttp-105 -126.5 143.06 51.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.091 179.658 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.537 ' ND2' ' HB3' ' A' ' 45' ' ' ALA . 44.4 p-10 -110.81 169.39 8.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.55 -179.452 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.85 -22.57 64.36 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.355 179.827 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.537 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . . . -73.73 5.79 3.72 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.793 179.214 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 67.58 22.65 9.09 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 121.015 0.436 . . . . 0.0 110.957 -179.264 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -109.43 137.97 46.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.306 179.335 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.463 HG22 ' HB2' ' A' ' 42' ' ' ARG . 52.2 p -121.52 161.56 22.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.752 0.311 . . . . 0.0 110.988 -179.803 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.33 174.77 47.24 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.692 -179.876 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.532 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 95.6 m-85 -107.7 111.23 23.33 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.783 0.325 . . . . 0.0 111.386 -179.684 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.654 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.5 t -122.41 109.54 32.89 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.189 179.609 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.05 32.64 0.27 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.214 1.943 . . . . 0.0 112.313 178.876 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.541 ' HB2' HG12 ' A' ' 51' ' ' VAL . 8.8 t -72.93 87.01 1.31 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 120.948 0.404 . . . . 0.0 111.065 -179.675 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -67.14 -8.66 32.67 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.757 178.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -63.34 -10.08 14.86 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.856 179.418 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.625 HG23 ' C ' ' A' ' 8' ' ' ILE . 5.6 p -118.05 142.11 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-O 120.895 0.378 . . . . 0.0 110.801 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.412 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 84.8 tt0 -147.04 159.56 43.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.824 -179.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.676 ' HB3' HG12 ' A' ' 7' ' ' VAL . 29.4 ptt180 -71.43 144.44 49.75 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.798 0.332 . . . . 0.0 111.18 179.836 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.9 tttt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.19 -0.909 . . . . 0.0 110.716 179.341 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.477 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 58.4 t . . . . . 0 N--CA 1.453 -0.277 0 CA-C-O 120.678 0.275 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.1 mt -115.35 119.28 61.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.167 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.733 HG12 ' HA ' ' A' ' 58' ' ' ARG . 28.0 m -132.16 161.13 41.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.08 179.477 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 28.0 mm -116.55 127.85 74.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.435 179.534 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.23 148.18 39.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -179.669 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 63.6 mttp -113.6 -16.83 12.29 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.671 179.951 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.532 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 16.1 m-90 -142.42 137.97 30.75 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.102 0.477 . . . . 0.0 110.655 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -63.62 123.74 19.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.035 -178.863 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.49 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 55.5 t80 -127.89 139.55 52.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.63 -179.613 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.15 138.62 40.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.191 179.212 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.74 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.27 127.42 29.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.445 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.41 ' OE1' ' CZ3' ' A' ' 38' ' ' TRP . 96.0 mt-30 -62.36 -35.02 77.82 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.148 0.499 . . . . 0.0 110.367 179.678 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -129.3 162.0 28.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.097 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -61.89 -34.66 76.44 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.014 0.435 . . . . 0.0 111.157 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -63.11 -24.75 68.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.444 -179.823 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.74 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.3 mm-40 -81.04 -179.58 7.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.117 0.485 . . . . 0.0 110.131 179.621 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.76 HD21 ' HB3' ' A' ' 43' ' ' ASN . 6.9 tp -119.42 144.58 46.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.517 -178.524 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -85.31 143.57 28.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.761 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.497 HD11 ' OG ' ' A' ' 53' ' ' SER . 38.8 pt -131.0 162.92 38.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.651 179.539 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 72.0 mmtt -110.97 176.2 5.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.163 0.506 . . . . 0.0 111.064 179.691 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.517 ' HG3' ' HA ' ' A' ' 11' ' ' TRP . 28.6 ttpp -63.08 -45.91 89.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.841 -178.827 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -109.76 -0.25 18.55 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.505 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 78.5 tt0 -64.63 145.3 56.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.423 0.63 . . . . 0.0 111.19 -179.405 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.448 ' C ' HD22 ' A' ' 29' ' ' LEU . 22.4 ptt-85 -99.26 121.96 41.77 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.533 -179.992 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.738 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.0 mm? -113.38 146.55 39.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.555 -179.099 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.411 ' C ' HG23 ' A' ' 41' ' ' VAL . 4.4 m-90 -102.11 108.35 19.73 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.268 179.804 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.477 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 83.8 mt -75.04 150.75 38.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.033 0.444 . . . . 0.0 111.638 -179.517 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -112.63 -28.43 7.82 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.664 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -160.99 118.47 2.36 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.853 0.359 . . . . 0.0 110.768 179.763 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.484 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 32.7 p-10 -106.84 1.23 24.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.282 -179.765 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.4 m -63.9 -37.36 87.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.889 0.376 . . . . 0.0 111.687 -179.435 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -81.91 158.67 23.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.148 -179.133 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.7 m -58.96 -37.01 75.78 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 177.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.41 ' CZ3' ' OE1' ' A' ' 16' ' ' GLN . 26.7 m95 -96.37 129.35 43.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.51 177.697 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.484 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 36.2 m0 -99.21 138.78 35.82 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.825 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.448 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 69.7 ttt180 -97.04 132.77 42.51 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.188 178.378 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.738 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.1 p -140.83 155.91 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.143 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.554 ' HG3' HG22 ' A' ' 48' ' ' THR . 37.4 ttm180 -125.23 140.16 53.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.69 -179.282 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.76 ' HB3' HD21 ' A' ' 21' ' ' LEU . 47.6 p-10 -108.92 172.13 7.03 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.174 0.512 . . . . 0.0 111.749 179.687 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.2 -24.34 67.16 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.168 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.598 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -73.36 3.47 5.88 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 179.472 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.6 t30 69.57 24.96 5.42 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 120.861 0.362 . . . . 0.0 111.28 -179.89 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.598 ' NH1' ' HB1' ' A' ' 45' ' ' ALA . 81.5 mtt85 -112.98 136.07 53.06 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.087 179.133 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.554 HG22 ' HG3' ' A' ' 42' ' ' ARG . 31.4 p -125.0 156.76 37.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.042 0.449 . . . . 0.0 111.704 -179.026 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -173.26 173.16 45.61 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.458 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.448 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.7 m-85 -102.66 110.12 21.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.882 0.372 . . . . 0.0 110.462 179.836 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.533 HG21 ' O ' ' A' ' 21' ' ' LEU . 13.1 t -121.98 110.14 33.27 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.658 -179.737 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -73.99 35.87 0.39 Allowed 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 121.824 1.682 . . . . 0.0 112.46 177.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.576 ' O ' HG12 ' A' ' 56' ' ' VAL . 23.1 t -68.54 87.52 0.32 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.826 0.345 . . . . 0.0 111.074 -179.44 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -59.83 -18.33 43.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.188 0.518 . . . . 0.0 110.062 177.54 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.532 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.9 m-85 -56.0 -17.05 5.78 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.657 179.589 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.576 HG12 ' O ' ' A' ' 53' ' ' SER . 7.1 p -113.07 142.98 23.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 CA-C-O 121.047 0.451 . . . . 0.0 110.86 -179.821 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.409 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 86.2 tt0 -141.86 159.94 41.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.766 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.733 ' HA ' HG12 ' A' ' 7' ' ' VAL . 78.8 mtp180 -69.59 141.62 53.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.835 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.721 179.58 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.48 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.8 t . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.728 0.299 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.6 mm -98.42 117.38 43.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.994 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.806 HG12 ' CA ' ' A' ' 58' ' ' ARG . 34.1 m -135.12 162.3 38.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.145 0.498 . . . . 0.0 112.05 -179.699 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.591 ' C ' HG23 ' A' ' 56' ' ' VAL . 15.4 mt -122.51 124.08 69.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.798 -179.464 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.614 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -76.59 119.94 21.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.073 0.463 . . . . 0.0 111.702 -179.491 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -91.56 -7.68 49.56 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.169 -179.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.72 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 15.9 m-90 -142.41 143.74 32.8 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.919 0.39 . . . . 0.0 110.536 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.7 p-10 -74.16 121.54 21.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.364 -179.13 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.447 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 60.9 t80 -127.91 138.22 52.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.67 179.914 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.3 t -101.41 142.57 32.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.768 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.776 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -58.03 132.42 53.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.836 -179.717 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.408 ' OE1' ' CH2' ' A' ' 38' ' ' TRP . 92.8 mt-30 -66.75 -30.38 70.58 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 121.131 0.491 . . . . 0.0 110.244 179.165 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -132.66 161.42 33.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.125 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -62.29 -31.95 72.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.895 0.379 . . . . 0.0 111.9 -179.163 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -71.17 -15.39 62.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.72 -179.744 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.776 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.4 mm-40 -84.79 -178.97 7.0 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.356 -179.388 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.883 HD21 ' HB2' ' A' ' 43' ' ' ASN . 13.1 tp -125.79 123.87 39.73 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -177.884 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -68.43 152.67 45.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.716 179.401 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.447 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 45.5 pt -133.98 162.13 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.098 179.249 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -117.11 164.84 14.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.285 0.564 . . . . 0.0 111.22 -179.934 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 52.0 pttt -64.54 -13.49 52.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.954 -179.591 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -140.72 24.77 2.21 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.331 179.643 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.556 ' HG2' HD22 ' A' ' 29' ' ' LEU . 80.5 tt0 -102.25 135.64 43.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.158 0.504 . . . . 0.0 110.871 179.845 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.487 ' HG2' HG23 ' A' ' 8' ' ' ILE . 87.0 mtm-85 -89.49 120.71 31.05 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.69 179.984 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.61 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.8 mm? -110.95 145.89 37.57 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.131 -177.792 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 27.1 m-90 -99.73 105.05 16.81 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.611 0.243 . . . . 0.0 111.216 179.173 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.48 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 96.1 mt -76.22 148.63 37.53 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.116 0.484 . . . . 0.0 111.2 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.559 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -112.77 -32.38 6.43 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.624 179.902 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -156.99 114.72 3.17 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.396 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.458 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 29.9 p-10 -109.27 1.79 20.4 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -179.035 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.4 m -65.02 -36.02 83.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.876 0.37 . . . . 0.0 111.584 -179.626 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -82.42 158.33 23.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.509 0.671 . . . . 0.0 112.488 -179.042 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 20.1 p -55.58 -39.42 70.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.354 178.112 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.408 ' CH2' ' OE1' ' A' ' 16' ' ' GLN . 28.8 m95 -93.26 133.28 36.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.759 -1.11 . . . . 0.0 108.285 177.24 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.458 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 33.9 m0 -105.48 131.35 53.01 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -177.871 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.465 ' HG2' HD13 ' A' ' 32' ' ' LEU . 29.6 ttp180 -91.06 133.11 35.58 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.753 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.61 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.7 p -143.61 159.72 16.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 C-N-CA 120.268 -0.573 . . . . 0.0 112.257 -177.554 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.727 ' HA ' HG22 ' A' ' 48' ' ' THR . 44.2 ttp180 -119.57 152.65 36.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.456 -179.08 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.883 ' HB2' HD21 ' A' ' 21' ' ' LEU . 58.4 t30 -120.46 159.73 24.55 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.749 0.309 . . . . 0.0 111.058 179.418 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.56 -21.34 52.47 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.849 178.765 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.424 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -80.45 5.7 14.37 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.171 179.19 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.8 m120 70.07 22.28 5.75 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 122.592 0.357 . . . . 0.0 111.311 -179.249 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.424 ' NH1' ' HB1' ' A' ' 45' ' ' ALA . 82.7 mtt85 -109.16 127.31 54.09 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.055 178.808 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.727 HG22 ' HA ' ' A' ' 42' ' ' ARG . 63.4 p -123.12 151.06 42.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.148 -179.61 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.439 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.57 174.9 40.63 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.561 179.856 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -105.16 110.88 23.43 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 117.0 0.4 . . . . 0.0 111.93 -179.436 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.56 HG13 ' HB3' ' A' ' 20' ' ' GLU . 16.0 m -132.46 115.45 14.85 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.12 178.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.35 43.58 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.773 1.649 . . . . 0.0 111.966 178.878 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.7 m -63.76 97.07 0.14 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.019 0.438 . . . . 0.0 110.462 -179.78 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -72.24 -15.67 61.93 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.498 179.093 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.72 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 89.2 m-85 -69.1 -10.47 57.79 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.452 -179.536 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.614 HG23 ' HA ' ' A' ' 9' ' ' ALA . 9.2 p -113.24 139.73 37.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 O-C-N 121.732 -0.605 . . . . 0.0 110.781 179.358 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -144.94 160.05 41.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.357 -179.81 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.806 ' CA ' HG12 ' A' ' 7' ' ' VAL . 36.9 ptt-85 -70.13 137.2 50.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.266 -179.475 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 61.9 tttm . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.744 179.81 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.53 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 56.0 t . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 120.737 0.303 . . . . 0.0 110.511 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.402 HG12 ' HD1' ' A' ' 30' ' ' TRP . 22.8 mt -104.73 121.01 56.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.825 179.816 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.677 HG12 ' HB3' ' A' ' 58' ' ' ARG . 25.5 m -132.72 161.07 42.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.97 0.414 . . . . 0.0 111.781 -179.798 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.705 ' C ' HG23 ' A' ' 56' ' ' VAL . 16.9 mt -120.99 128.05 76.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.005 -179.918 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -77.64 127.26 32.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.004 -179.988 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -93.74 -13.31 27.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.449 179.596 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.475 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 7.3 m-90 -140.58 154.12 46.37 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-O 120.999 0.428 . . . . 0.0 111.311 -179.699 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.473 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 11.4 t70 -76.58 123.82 26.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.525 -179.493 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.477 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 63.3 t80 -127.97 140.36 52.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.157 -179.776 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.1 m -104.19 138.02 41.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.703 179.571 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.61 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -59.0 138.03 57.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.784 -179.814 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -86.77 -0.27 56.06 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.455 178.703 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.531 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 78.1 mt-30 -147.75 167.42 24.73 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.135 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -73.67 -29.97 62.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.007 0.432 . . . . 0.0 111.361 -179.638 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -76.25 -14.94 60.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.208 -179.393 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.61 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -85.79 178.08 7.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.915 0.388 . . . . 0.0 111.04 -179.467 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.57 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.6 mp -124.85 141.64 51.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.3 0.572 . . . . 0.0 111.481 -178.19 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -80.77 147.78 30.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.746 179.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.477 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 47.0 pt -129.2 164.88 30.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.222 179.228 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 68.8 mttm -116.5 176.78 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.18 0.514 . . . . 0.0 112.037 -179.095 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.475 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 28.1 mttt -61.7 -30.17 70.57 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.838 -179.871 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -133.78 53.34 2.01 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.064 0.459 . . . . 0.0 110.903 -179.483 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.452 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 80.2 tt0 -117.08 137.69 52.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.038 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.53 ' HG2' HG12 ' A' ' 8' ' ' ILE . 94.0 mtm-85 -96.77 122.79 40.11 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.197 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.713 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -117.04 147.88 41.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.081 -179.873 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.402 ' HD1' HG12 ' A' ' 6' ' ' ILE . 5.2 m-90 -99.99 106.53 18.33 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.209 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.53 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 80.0 mt -76.24 146.39 39.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.094 0.473 . . . . 0.0 111.633 -179.401 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -111.69 -30.51 7.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.753 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -161.01 120.13 2.57 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.474 179.548 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.48 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.1 p-10 -110.84 1.54 17.74 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -179.46 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.7 m -63.41 -39.04 93.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.741 0.305 . . . . 0.0 111.532 -179.576 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -81.72 158.82 24.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.007 0.432 . . . . 0.0 111.656 -179.511 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.9 -35.01 68.49 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.077 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.602 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 61.2 m95 -96.92 129.38 44.38 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.453 177.668 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.495 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 39.4 m0 -104.17 132.71 50.14 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -177.662 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.572 ' HG2' HD13 ' A' ' 32' ' ' LEU . 65.5 ttt180 -87.92 134.12 33.78 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.592 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.713 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.2 p -139.73 161.22 27.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.761 -178.796 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.46 ' CB ' HG22 ' A' ' 48' ' ' THR . 42.9 ttm180 -125.54 142.01 51.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.837 -179.715 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -111.88 165.63 11.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.471 -179.523 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.69 -27.67 65.04 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.448 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -72.8 5.11 3.42 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.886 179.191 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.6 m120 69.23 25.68 5.61 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.002 0.43 . . . . 0.0 111.058 -179.659 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.548 ' O ' HD21 ' A' ' 21' ' ' LEU . 21.8 ttt180 -110.72 131.5 55.0 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.221 179.227 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.46 HG22 ' CB ' ' A' ' 42' ' ' ARG . 75.7 p -119.73 156.87 29.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.146 -179.818 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.46 177.7 44.94 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.103 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.567 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.0 m-85 -108.73 115.01 29.28 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.464 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.57 HG11 ' O ' ' A' ' 21' ' ' LEU . 12.6 m -128.59 110.32 19.06 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.601 179.407 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.602 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 57.9 Cg_endo -72.41 32.41 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.406 2.071 . . . . 0.0 112.218 178.481 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.462 ' O ' HG12 ' A' ' 56' ' ' VAL . 11.7 t -68.4 84.81 0.27 Allowed 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.471 -179.917 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -64.65 -11.3 33.92 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.866 178.743 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -62.93 -9.84 11.32 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 179.591 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.705 HG23 ' C ' ' A' ' 8' ' ' ILE . 6.2 p -117.91 139.1 46.37 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-O 121.022 0.439 . . . . 0.0 110.679 179.663 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -142.54 161.9 36.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.624 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.677 ' HB3' HG12 ' A' ' 7' ' ' VAL . 33.2 ptt-85 -71.14 141.12 50.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.875 0.369 . . . . 0.0 111.218 -179.803 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.6 tttt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.142 -0.932 . . . . 0.0 110.671 179.551 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.416 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.0 t . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 120.71 0.291 . . . . 0.0 110.553 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.2 mt -115.37 118.38 58.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.333 -179.647 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.722 HG12 ' HA ' ' A' ' 58' ' ' ARG . 29.1 m -132.14 160.21 42.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.941 0.4 . . . . 0.0 111.278 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.553 ' C ' HG23 ' A' ' 56' ' ' VAL . 35.3 mt -116.75 126.87 74.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.472 179.577 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.585 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.0 149.83 39.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.587 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -112.37 -20.65 11.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.183 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.514 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 16.4 m-90 -140.42 150.58 44.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.641 -179.944 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.48 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 50.9 t0 -72.97 124.57 25.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.346 -179.322 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 57.1 t80 -127.52 133.89 49.81 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.577 179.621 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.5 m -101.51 139.15 37.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.047 0.451 . . . . 0.0 111.104 -179.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.796 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.23 129.72 39.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.693 -179.905 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -65.53 -31.8 73.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.118 0.485 . . . . 0.0 110.008 179.345 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -130.99 163.81 26.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.114 179.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -64.61 -34.69 78.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.97 0.414 . . . . 0.0 111.266 -179.622 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.1 -19.39 65.96 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.444 -179.882 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.796 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 -82.63 -178.93 7.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.65 0.262 . . . . 0.0 111.175 -179.803 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.946 HD21 ' HB2' ' A' ' 43' ' ' ASN . 26.1 tp -120.79 134.44 55.29 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.161 0.505 . . . . 0.0 112.167 -178.326 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -78.86 145.64 34.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.15 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.48 HG22 HD11 ' A' ' 29' ' ' LEU . 31.3 pt -132.66 163.82 36.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.071 179.129 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 90.6 mttt -114.6 -176.74 2.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.232 0.539 . . . . 0.0 111.514 -179.545 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.48 ' HG2' ' HB2' ' A' ' 12' ' ' ASP . 63.6 mttt -63.37 -57.47 10.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.938 -179.494 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -100.02 -12.73 19.48 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.47 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 77.1 tt0 -51.83 143.15 13.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.886 0.374 . . . . 0.0 111.681 -178.989 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.547 ' C ' HD22 ' A' ' 29' ' ' LEU . 98.1 mtt180 -97.78 124.99 42.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.977 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.758 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.7 mm? -114.27 143.3 45.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.064 0.459 . . . . 0.0 111.695 -179.254 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.449 ' O ' HD22 ' A' ' 32' ' ' LEU . 4.0 m-90 -101.42 105.87 16.94 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.557 179.727 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.531 ' C ' HD22 ' A' ' 32' ' ' LEU . 79.3 mt -69.87 149.87 47.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.303 0.573 . . . . 0.0 111.936 -179.024 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.667 HD23 ' HA ' ' A' ' 41' ' ' VAL . 3.6 mm? -119.29 -31.88 4.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.797 -178.23 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -113.28 -83.74 0.6 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.114 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.514 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 18.2 m-20 72.01 3.84 4.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.899 -179.418 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.1 m -82.5 -36.04 26.82 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.886 0.374 . . . . 0.0 111.151 179.883 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -104.17 168.84 8.85 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.997 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 16.0 m -55.68 -30.31 60.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.673 178.494 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -97.56 126.97 43.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.854 178.253 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.514 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 42.5 m0 -106.88 134.22 50.35 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.582 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.483 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 58.4 ttp180 -92.24 127.21 37.63 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 177.475 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.758 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -135.1 161.73 39.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -178.293 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.458 ' HA ' HG22 ' A' ' 48' ' ' THR . 57.1 ttm-85 -123.25 139.9 53.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.713 -179.547 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.946 ' HB2' HD21 ' A' ' 21' ' ' LEU . 52.4 t30 -110.34 161.57 15.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.864 0.364 . . . . 0.0 111.274 179.878 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.25 -21.03 46.77 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.552 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.93 5.03 14.97 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.836 179.735 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 72.78 22.57 3.1 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.852 0.358 . . . . 0.0 111.001 -179.637 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.4 ' C ' HD13 ' A' ' 21' ' ' LEU . 99.7 mtt180 -107.23 132.44 53.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.158 179.242 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.458 HG22 ' HA ' ' A' ' 42' ' ' ARG . 73.2 p -127.27 151.0 49.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.696 0.284 . . . . 0.0 111.079 -179.592 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.497 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -170.5 172.84 44.27 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.577 -0.821 . . . . 0.0 113.115 -179.973 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.483 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 85.8 m-85 -101.52 114.04 27.7 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.641 0.258 . . . . 0.0 111.134 -179.905 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.518 HG13 ' HB3' ' A' ' 20' ' ' GLU . 15.7 m -136.05 114.15 10.77 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.737 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.24 43.21 0.84 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.164 1.909 . . . . 0.0 111.865 178.618 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.504 ' O ' HG12 ' A' ' 56' ' ' VAL . 88.6 p -71.07 90.3 0.85 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.001 0.429 . . . . 0.0 111.282 -179.383 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -66.21 -12.68 57.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.371 178.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.514 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.0 m-85 -62.63 -12.95 26.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.159 -179.995 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.585 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.2 p -115.35 141.18 33.3 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.099 0 CA-C-O 120.95 0.405 . . . . 0.0 110.695 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -137.94 164.73 28.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.331 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.722 ' HA ' HG12 ' A' ' 7' ' ' VAL . 17.1 mtp-105 -69.93 143.88 52.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.66 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.142 -0.932 . . . . 0.0 110.992 179.947 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.445 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.5 t . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 120.82 0.343 . . . . 0.0 110.708 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.7 mt -113.87 116.06 51.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.98 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.661 HG12 ' HB3' ' A' ' 58' ' ' ARG . 23.0 m -132.23 161.1 41.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.837 0.351 . . . . 0.0 111.568 179.923 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.964 HD12 ' HD2' ' A' ' 59' ' ' LYS . 15.5 mt -119.0 123.0 70.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.288 -179.668 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.676 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.62 123.58 25.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.631 -179.718 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.472 ' HE3' ' HE2' ' A' ' 59' ' ' LYS . 38.8 mttp -93.7 -10.63 33.74 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.081 -179.955 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.787 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 11.1 m-90 -140.74 145.11 35.99 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.944 0.402 . . . . 0.0 110.839 179.841 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -72.81 122.21 21.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.083 -179.281 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.463 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 57.5 t80 -127.55 139.77 52.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.101 179.99 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 91.1 m -103.02 138.96 39.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.675 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.62 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -61.88 139.23 58.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.519 -179.667 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -87.83 -1.23 57.84 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.464 179.23 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.498 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 93.1 mt-30 -145.99 169.71 18.08 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 178.791 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -75.13 -33.36 61.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.106 0.479 . . . . 0.0 110.945 -179.645 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -71.43 -16.32 62.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.925 -179.635 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.62 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -86.56 178.73 6.98 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.022 -179.649 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.46 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.1 mp -129.59 139.04 51.57 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-O 121.098 0.475 . . . . 0.0 111.859 -177.754 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -74.72 148.55 40.41 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.852 179.324 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.447 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 41.8 pt -129.29 164.0 32.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.911 179.221 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.445 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 96.9 mttt -118.99 163.64 16.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.141 0.496 . . . . 0.0 111.141 -179.858 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.485 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 10.8 pttm -63.87 -10.53 21.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.52 -0.764 . . . . 0.0 113.029 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -140.68 26.4 2.11 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.013 179.494 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.454 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 82.4 tt0 -102.03 143.11 32.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.046 0.45 . . . . 0.0 110.705 179.899 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.495 ' C ' HD22 ' A' ' 29' ' ' LEU . 82.6 mtm-85 -95.33 119.41 33.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.291 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.673 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -116.12 145.21 43.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.128 -179.661 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -100.92 107.53 19.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.492 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.445 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 63.6 mt -77.9 149.66 34.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.119 0.485 . . . . 0.0 111.538 -179.583 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.498 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.8 mp -114.55 -29.84 6.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.039 179.795 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -157.05 115.0 3.19 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.883 0.373 . . . . 0.0 110.601 179.772 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.495 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 35.7 p-10 -106.28 2.34 26.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.229 -179.49 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 87.6 p -67.67 -37.63 82.62 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.904 0.383 . . . . 0.0 111.904 -179.351 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -81.61 162.08 23.24 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.328 0.585 . . . . 0.0 112.38 -179.044 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.491 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 17.1 p -57.55 -39.74 77.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.856 177.838 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.508 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 54.3 m95 -96.97 130.21 44.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.47 -1.241 . . . . 0.0 108.745 177.791 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.495 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 38.2 m0 -102.62 132.97 48.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -177.862 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.485 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 51.9 ttt180 -87.45 132.07 34.12 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 177.794 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.673 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -138.9 157.12 28.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.926 0.393 . . . . 0.0 111.81 -178.724 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.435 ' CB ' HG22 ' A' ' 48' ' ' THR . 43.4 ttm180 -119.49 142.97 47.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.988 -179.664 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -113.08 163.16 15.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.391 -179.502 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.23 -20.68 43.73 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.463 179.769 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.603 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -77.79 5.79 8.8 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 179.679 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.1 m120 68.48 26.92 6.43 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 120.948 0.404 . . . . 0.0 111.307 -179.903 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.603 ' NH1' ' HB1' ' A' ' 45' ' ' ALA . 83.3 mtt85 -115.05 144.5 43.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.55 178.719 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.435 HG22 ' CB ' ' A' ' 42' ' ' ARG . 75.5 p -129.74 153.91 47.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.568 0.223 . . . . 0.0 110.715 -179.867 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -169.02 176.12 43.24 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.552 -179.728 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.485 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 94.7 m-85 -108.13 114.6 28.62 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.217 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.55 HG13 ' HB3' ' A' ' 20' ' ' GLU . 6.0 m -133.16 111.22 12.98 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.812 179.255 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.508 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 13.7 Cg_exo -70.18 41.16 0.34 Allowed 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.734 2.29 . . . . 0.0 112.502 178.487 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.598 ' O ' HG12 ' A' ' 56' ' ' VAL . 6.7 p -69.03 74.19 0.3 Allowed 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 120.676 0.274 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -54.13 -17.51 2.82 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.146 -0.346 . . . . 0.0 111.223 178.708 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.787 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 91.1 m-85 -61.43 -8.06 3.71 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 179.26 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.676 HG23 ' HA ' ' A' ' 9' ' ' ALA . 9.2 p -111.2 140.15 31.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 O-C-N 121.386 -0.821 . . . . 0.0 110.727 179.808 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -136.55 150.57 48.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.224 179.803 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.661 ' HB3' HG12 ' A' ' 7' ' ' VAL . 33.6 ptt-85 -72.0 147.26 47.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.315 -179.465 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.964 ' HD2' HD12 ' A' ' 8' ' ' ILE . 98.5 mttt . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.306 -0.854 . . . . 0.0 110.82 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 79.2 t . . . . . 0 C--O 1.226 -0.176 0 CA-C-O 120.365 0.126 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.5 mt -105.59 114.71 45.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.712 0.291 . . . . 0.0 111.751 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.722 HG12 ' HA ' ' A' ' 58' ' ' ARG . 30.8 m -132.98 159.46 43.17 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.741 0.305 . . . . 0.0 110.987 179.054 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.613 ' HB ' ' HD2' ' A' ' 59' ' ' LYS . 54.3 mt -121.5 124.28 71.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.062 0.458 . . . . 0.0 111.395 179.96 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.688 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.13 124.76 27.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.085 -179.989 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -93.08 -9.18 40.5 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.837 -179.992 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.813 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 14.3 m-90 -143.58 147.06 33.84 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.866 0.365 . . . . 0.0 110.473 179.431 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.3 p-10 -73.67 124.04 25.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.438 -178.719 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.46 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 46.3 t80 -128.64 135.09 48.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.511 179.173 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 66.8 m -100.36 139.88 35.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.267 0.556 . . . . 0.0 111.489 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.825 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.43 130.51 46.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.488 179.813 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -65.16 -28.21 69.25 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.015 0.436 . . . . 0.0 110.246 179.106 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -135.45 162.33 32.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.111 179.36 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -64.16 -29.91 71.0 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.904 0.383 . . . . 0.0 111.274 -179.705 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -69.48 -19.25 63.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.634 -179.757 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.825 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.3 mm-40 -82.55 -177.56 6.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.512 179.888 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.916 HD21 ' HB2' ' A' ' 43' ' ' ASN . 20.3 tp -123.7 133.14 53.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.138 0.494 . . . . 0.0 111.692 -178.913 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -77.65 148.56 34.97 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.806 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.472 HG22 ' HG ' ' A' ' 29' ' ' LEU . 36.6 pt -131.93 163.56 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.335 179.39 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 73.4 mmtt -118.38 164.2 15.6 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.144 0.497 . . . . 0.0 111.352 179.919 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.5 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 33.4 pttt -65.74 -11.11 42.91 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -179.671 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -140.6 23.34 2.3 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.168 179.638 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.472 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 78.6 tt0 -102.62 139.73 37.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.067 0.46 . . . . 0.0 110.695 179.939 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.58 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 11.9 ptp180 -95.25 121.38 36.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.212 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.658 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -113.58 152.69 29.96 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.517 -178.966 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.428 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 11.2 m-90 -103.36 105.57 15.87 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.501 -179.661 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.485 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 71.8 mt -77.63 146.34 36.19 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.076 0.465 . . . . 0.0 111.865 -179.335 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.569 HD13 ' HG2' ' A' ' 40' ' ' ARG . 4.9 mp -110.63 -29.53 7.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.203 179.976 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -158.96 116.74 2.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.865 0.364 . . . . 0.0 110.698 -179.672 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.485 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 42.6 p-10 -108.83 4.49 23.62 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.114 -179.381 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.7 m -68.32 -35.57 77.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.84 0.352 . . . . 0.0 111.383 -179.429 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -84.27 158.4 21.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.071 -179.162 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.476 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 19.3 p -55.36 -40.65 71.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.337 -0.847 . . . . 0.0 108.841 177.74 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.595 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 56.2 m95 -93.84 129.28 40.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.452 -1.249 . . . . 0.0 109.102 177.845 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.491 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 37.4 m0 -101.16 137.61 39.29 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.055 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.569 ' HG2' HD13 ' A' ' 32' ' ' LEU . 64.5 ttt180 -93.03 135.36 34.27 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 177.443 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.658 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -145.63 159.19 12.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.569 -178.935 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.633 ' HA ' HG22 ' A' ' 48' ' ' THR . 78.1 ttt180 -124.02 144.08 50.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.154 179.999 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.916 ' HB2' HD21 ' A' ' 21' ' ' LEU . 54.7 t30 -113.43 163.35 14.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.308 179.855 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.42 -24.7 63.7 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.662 -179.974 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.28 5.72 8.03 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.691 179.059 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 71.92 20.55 4.41 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.314 0.245 . . . . 0.0 111.08 -179.813 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -105.89 125.16 50.66 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.597 179.644 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.633 HG22 ' HA ' ' A' ' 42' ' ' ARG . 76.9 p -121.13 149.86 42.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.126 -179.732 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.62 176.74 40.43 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.639 179.719 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.491 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 85.7 m-85 -107.64 110.85 22.83 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.878 0.339 . . . . 0.0 111.579 -179.87 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.654 HG13 ' HB3' ' A' ' 20' ' ' GLU . 12.1 m -134.08 117.05 13.55 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 111.493 0.183 . . . . 0.0 111.493 179.515 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.595 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 57.6 Cg_endo -71.75 53.47 1.87 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.319 2.013 . . . . 0.0 111.613 179.111 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.646 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.8 m -66.92 92.99 0.25 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.093 -179.513 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.3 m120 -77.26 -10.4 59.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.902 0.382 . . . . 0.0 110.186 178.055 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.813 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 86.1 m-85 -81.37 6.24 15.03 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.323 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.688 HG23 ' HA ' ' A' ' 9' ' ' ALA . 13.2 p -118.08 144.66 25.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 O-C-N 121.946 -0.472 . . . . 0.0 110.51 179.591 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -128.09 156.82 42.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.824 -179.674 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.722 ' HA ' HG12 ' A' ' 7' ' ' VAL . 17.1 mtp-105 -73.43 142.44 46.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.793 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.613 ' HD2' ' HB ' ' A' ' 8' ' ' ILE . 56.3 mttm . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.876 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.428 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 58.6 t . . . . . 0 N--CA 1.455 -0.209 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.44 HG12 ' CD1' ' A' ' 30' ' ' TRP . 50.3 mt -111.28 117.39 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.008 179.8 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.794 HG12 ' CA ' ' A' ' 58' ' ' ARG . 32.9 m -131.18 160.79 42.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.071 179.646 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.581 ' C ' HG23 ' A' ' 56' ' ' VAL . 16.8 mt -119.84 122.17 67.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.822 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.496 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -77.01 124.33 27.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.265 -179.925 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.456 ' CE ' ' HE2' ' A' ' 59' ' ' LYS . 94.8 mttt -92.97 -11.05 34.21 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.905 179.813 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.706 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 9.2 m-90 -140.42 146.51 38.4 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.744 0.307 . . . . 0.0 110.553 -179.762 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -75.57 124.08 26.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.238 0.542 . . . . 0.0 111.553 -178.371 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.493 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 59.0 t80 -128.05 136.48 51.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.623 179.683 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 59.6 m -103.82 139.99 38.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.815 179.777 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.581 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -58.06 137.09 57.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.891 -179.937 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -86.72 -3.77 59.09 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.234 178.486 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.452 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 81.5 mm-40 -143.07 162.64 34.97 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.857 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -71.93 -19.67 61.87 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.706 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -89.21 -10.67 46.16 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -179.506 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.581 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.1 mt-10 -83.33 179.54 7.66 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.036 0.446 . . . . 0.0 110.247 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.797 HD21 ' HB2' ' A' ' 43' ' ' ASN . 15.9 tp -122.84 128.49 50.45 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.914 -178.394 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -71.76 147.62 47.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.41 179.729 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.493 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 40.1 pt -132.23 161.87 40.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.761 179.461 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 99.0 mttt -117.67 163.09 16.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.073 0.464 . . . . 0.0 111.226 -179.87 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.472 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 55.4 pttt -64.18 -12.17 37.79 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -179.667 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -138.84 22.94 2.65 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.942 179.355 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.479 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 51.6 tp10 -100.12 140.93 33.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.105 0.478 . . . . 0.0 111.219 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.441 ' C ' HD22 ' A' ' 29' ' ' LEU . 61.2 mtt85 -91.94 122.43 34.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.704 -179.852 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.694 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.4 mm? -115.29 145.31 42.6 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.612 -178.386 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.44 ' CD1' HG12 ' A' ' 6' ' ' ILE . 6.3 m0 -101.65 107.63 18.94 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.547 179.648 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.437 ' HA ' HG23 ' A' ' 41' ' ' VAL . 92.9 mt -79.18 148.83 32.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.342 0.591 . . . . 0.0 112.146 -179.205 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.9 mp -112.06 -28.96 7.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.486 179.181 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -161.05 118.08 2.31 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.264 179.496 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.504 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.6 p-10 -113.22 11.76 18.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.111 -179.472 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.2 p -71.21 -37.87 72.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.913 0.387 . . . . 0.0 111.288 -179.678 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.07 160.95 20.84 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.411 0.624 . . . . 0.0 112.344 -179.269 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 36.5 p -55.3 -40.37 71.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.061 178.002 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.553 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 50.7 m95 -92.39 132.67 36.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.819 177.812 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.504 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -106.84 138.67 42.58 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.054 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.482 ' HG2' HD13 ' A' ' 32' ' ' LEU . 56.2 ttt180 -96.1 129.08 43.48 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.161 177.867 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.694 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.4 p -141.74 159.23 21.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -177.987 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.45 ' CB ' HG22 ' A' ' 48' ' ' THR . 71.3 ttt180 -124.07 141.87 51.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.289 -179.627 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.797 ' HB2' HD21 ' A' ' 21' ' ' LEU . 48.7 t30 -110.12 162.69 14.32 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 120.985 0.422 . . . . 0.0 111.021 179.281 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.01 -19.32 51.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.922 178.608 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.56 5.59 8.79 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.027 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 66.56 26.96 9.76 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.165 0.507 . . . . 0.0 111.105 -179.455 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.458 ' O ' HD13 ' A' ' 21' ' ' LEU . 57.3 ttm-85 -113.79 125.32 53.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.822 178.957 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.45 HG22 ' CB ' ' A' ' 42' ' ' ARG . 77.6 p -118.51 143.59 46.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.936 0.398 . . . . 0.0 111.554 -179.221 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.562 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -161.06 172.01 37.23 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.75 179.961 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.478 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 95.7 m-85 -104.71 107.87 19.04 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 117.019 0.409 . . . . 0.0 111.995 -179.432 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.517 HG11 ' O ' ' A' ' 21' ' ' LEU . 11.4 m -122.75 120.12 27.85 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.305 178.744 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.553 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 61.7 Cg_endo -73.54 31.59 0.32 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.39 2.06 . . . . 0.0 112.542 178.484 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 86.4 p -61.72 93.95 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 120.997 0.427 . . . . 0.0 111.178 -179.641 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -78.6 -4.85 50.93 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.593 178.321 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.706 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 86.1 m-85 -72.18 -9.77 58.89 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.405 179.22 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.581 HG23 ' C ' ' A' ' 8' ' ' ILE . 6.9 p -120.2 139.71 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 121.187 0.518 . . . . 0.0 110.614 -179.819 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -144.1 160.21 41.29 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.072 179.88 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.794 ' CA ' HG12 ' A' ' 7' ' ' VAL . 77.9 ttt-85 -69.4 138.57 53.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.928 0.394 . . . . 0.0 110.919 -179.688 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.55 ' HD2' HD12 ' A' ' 8' ' ' ILE . 95.2 mttt . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.839 -179.901 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.479 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.0 t . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.43 HG23 ' CD1' ' A' ' 30' ' ' TRP . 8.4 mt -109.88 117.02 53.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.388 -179.743 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.712 HG12 ' CA ' ' A' ' 58' ' ' ARG . 33.1 m -131.94 160.35 42.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.831 0.348 . . . . 0.0 111.157 179.466 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.678 HG23 ' HG2' ' A' ' 28' ' ' ARG . 21.4 mt -117.63 126.66 74.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.844 179.735 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.545 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.79 149.68 39.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.147 0.498 . . . . 0.0 110.867 -179.885 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -112.02 -21.43 11.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.948 179.87 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.503 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 20.3 m-90 -139.26 151.3 46.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.838 179.991 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.509 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 57.1 t0 -74.59 125.45 28.67 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.07 0.462 . . . . 0.0 111.196 -178.761 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.488 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 61.2 t80 -128.08 137.5 52.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.942 179.813 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.8 t -103.49 139.28 39.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.651 179.784 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.841 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.19 129.81 43.41 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.42 -179.935 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.416 ' HG2' ' OH ' ' A' ' 13' ' ' TYR . 95.2 mm-40 -62.85 -33.46 75.3 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.308 0.575 . . . . 0.0 110.186 179.471 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -131.39 161.67 31.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.205 179.739 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -62.03 -33.9 75.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.084 0.469 . . . . 0.0 111.288 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -65.87 -20.16 66.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.202 179.888 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.841 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.8 mm-40 -83.32 179.24 7.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 0.0 110.979 -179.663 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.826 HD21 ' HB3' ' A' ' 43' ' ' ASN . 39.8 tp -121.7 126.06 48.09 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.893 -178.547 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -73.18 159.07 34.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.804 179.314 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.488 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 41.5 pt -141.83 166.87 16.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.366 179.807 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.486 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 57.1 mttm -114.48 178.67 4.2 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.215 0.531 . . . . 0.0 111.524 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.509 ' HG2' ' HB2' ' A' ' 12' ' ' ASP . 20.6 mttp -61.49 -52.31 65.03 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.234 -179.543 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -107.13 -1.36 22.04 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -178.097 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.486 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 79.5 tt0 -62.89 144.43 56.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.233 0.539 . . . . 0.0 111.205 -179.541 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.678 ' HG2' HG23 ' A' ' 8' ' ' ILE . 75.5 mtp180 -100.36 120.82 40.53 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.313 -179.984 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.684 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.2 mm? -111.65 149.37 31.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.549 -178.758 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.462 ' C ' HG23 ' A' ' 41' ' ' VAL . 5.2 m-90 -103.91 107.73 18.75 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.126 179.709 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.479 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 88.0 mt -76.23 147.68 38.18 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.031 0.443 . . . . 0.0 111.996 -179.172 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.2 mp -109.8 -28.93 8.54 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.596 179.482 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -160.97 117.71 2.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.69 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.522 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.5 p-10 -110.53 3.04 19.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.132 -179.558 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.6 m -63.96 -38.4 90.93 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.772 0.32 . . . . 0.0 111.61 -179.735 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.69 162.76 19.57 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.331 0.586 . . . . 0.0 112.506 -179.075 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.456 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 19.6 p -58.94 -37.23 76.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.244 178.291 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.635 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 68.6 m95 -94.77 131.05 41.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.579 -1.191 . . . . 0.0 108.525 177.959 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.522 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -105.44 137.08 43.84 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.492 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 69.2 ttt180 -94.61 129.9 41.27 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.048 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.778 HG13 HD23 ' A' ' 21' ' ' LEU . 2.4 p -143.29 155.1 16.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 C-N-CA 120.382 -0.527 . . . . 0.0 112.155 -178.384 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.707 ' HG3' HG22 ' A' ' 48' ' ' THR . 28.4 ttp-105 -123.74 142.2 51.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.912 -179.613 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.826 ' HB3' HD21 ' A' ' 21' ' ' LEU . 43.6 p-10 -111.65 171.66 7.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.676 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.5 -26.72 68.69 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.381 -179.978 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.468 ' HB3' HD21 ' A' ' 43' ' ' ASN . . . -71.37 5.4 2.3 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 179.451 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 66.57 25.14 10.08 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.092 0.472 . . . . 0.0 111.026 -179.404 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -110.32 127.8 55.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.598 178.945 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.707 HG22 ' HG3' ' A' ' 42' ' ' ARG . 11.8 p -121.79 145.63 47.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.724 0.297 . . . . 0.0 110.878 -179.344 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.484 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.92 170.46 39.99 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.996 179.73 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.492 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 90.6 m-85 -101.56 112.45 25.01 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -179.436 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.585 HG13 ' HB3' ' A' ' 20' ' ' GLU . 15.8 m -135.22 116.09 12.05 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.59 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.635 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 63.2 Cg_endo -73.09 45.44 0.95 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.384 2.056 . . . . 0.0 111.903 179.044 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.536 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.6 p -70.21 85.22 0.56 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.792 -179.663 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -63.9 -14.6 54.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.008 0.432 . . . . 0.0 110.443 178.724 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.503 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 94.4 m-85 -61.32 -14.6 28.24 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.624 179.367 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.66 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.3 p -118.23 140.03 43.19 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 CA-C-O 121.182 0.515 . . . . 0.0 111.201 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -145.5 159.13 43.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.381 179.676 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.712 ' CA ' HG12 ' A' ' 7' ' ' VAL . 80.5 ttt180 -71.0 135.2 47.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.839 0.352 . . . . 0.0 110.842 179.912 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.054 179.656 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.7 mmm . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.838 0.351 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 67.4 p -78.37 148.31 33.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.08 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -97.98 139.28 34.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.091 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -97.18 137.74 35.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.174 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.449 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 79.9 t -112.09 129.93 66.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.377 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 30.3 mm -98.49 114.58 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.16 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.466 HG21 HD11 ' A' ' 31' ' ' LEU . 22.4 m -132.25 165.66 31.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.969 0.414 . . . . 0.0 111.259 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.645 HG23 ' HG2' ' A' ' 28' ' ' ARG . 10.4 mt -128.84 129.02 68.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.51 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.702 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.93 141.14 45.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.605 -178.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -105.11 -20.18 13.6 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.746 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.585 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 18.4 m-90 -140.98 150.67 43.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.973 0.416 . . . . 0.0 110.027 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.8 p-10 -69.56 129.72 40.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.216 0.531 . . . . 0.0 112.072 -178.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.411 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 76.6 t80 -127.9 140.58 51.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.772 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.9 t -105.85 138.47 41.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.599 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.539 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -58.91 138.32 57.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.38 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -86.09 -3.26 58.91 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.364 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -146.17 170.15 17.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.708 0.29 . . . . 0.0 110.283 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -74.02 -27.29 60.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.497 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -80.56 -9.71 59.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.611 ' C ' HD12 ' A' ' 21' ' ' LEU . 0.5 OUTLIER -93.26 171.98 8.58 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.758 -179.889 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.611 HD12 ' C ' ' A' ' 20' ' ' GLU . 8.0 mp -120.19 134.88 55.15 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -74.62 147.0 42.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.424 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.698 HG22 HD11 ' A' ' 29' ' ' LEU . 46.0 pt -127.73 169.4 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.022 179.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -117.34 -176.74 3.07 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.158 0.504 . . . . 0.0 111.85 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -65.85 -37.55 86.5 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.786 -178.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -126.78 39.06 4.0 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.873 0.368 . . . . 0.0 111.409 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -100.37 132.41 45.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.835 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.645 ' HG2' HG23 ' A' ' 8' ' ' ILE . 50.9 mtm105 -88.08 125.7 34.71 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.451 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.698 HD11 HG22 ' A' ' 23' ' ' ILE . 1.1 mm? -116.07 150.31 37.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.824 -178.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 31.1 m-90 -102.62 105.82 16.38 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.442 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.611 HD23 HG23 ' A' ' 41' ' ' VAL . 88.4 mt -79.62 142.55 35.51 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.927 0.394 . . . . 0.0 112.028 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 41' ' ' VAL . 3.9 mp -111.3 -29.11 7.95 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.186 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -158.57 117.6 3.07 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.861 0.363 . . . . 0.0 111.251 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.44 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.4 p-10 -110.56 4.84 20.68 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.2 m -67.79 -36.22 80.05 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.815 0.341 . . . . 0.0 111.326 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -83.54 158.61 21.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.667 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 89.6 m -56.35 -35.22 67.38 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.332 178.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.9 m0 -99.15 133.05 43.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.44 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 42.2 m0 -104.39 134.68 47.19 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.422 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 53.4 ttt180 -86.62 133.08 33.73 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 178.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.632 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -137.78 161.49 33.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.02 0.438 . . . . 0.0 111.91 -177.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.429 ' CB ' HG22 ' A' ' 48' ' ' THR . 79.8 ttt180 -124.24 149.7 46.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.621 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.607 HD22 HD23 ' A' ' 21' ' ' LEU . 8.4 m-20 -121.81 160.72 24.05 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.08 0.466 . . . . 0.0 111.488 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -55.97 -19.83 13.98 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.6 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.99 5.35 11.91 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 72.56 22.74 3.23 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 122.527 0.331 . . . . 0.0 111.452 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.401 ' C ' HD21 ' A' ' 21' ' ' LEU . 95.5 mtt-85 -108.19 146.43 32.78 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.429 HG22 ' CB ' ' A' ' 42' ' ' ARG . 75.6 p -134.95 147.78 49.86 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.846 179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -169.26 174.72 43.7 Favored Glycine 0 C--N 1.339 0.733 0 C-N-CA 120.632 -0.794 . . . . 0.0 113.29 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 89.4 m-85 -102.59 108.31 19.54 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.544 HG11 ' O ' ' A' ' 21' ' ' LEU . 22.3 m -127.32 115.87 21.52 Favored Pre-proline 0 CA--C 1.533 0.314 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.1 63.65 4.19 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 121.564 1.51 . . . . 0.0 110.968 178.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.713 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.0 OUTLIER -72.98 76.72 1.18 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.516 -178.825 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -60.45 -19.17 55.52 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.208 177.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.585 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 71.5 m-85 -86.91 44.21 1.15 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.004 -0.544 . . . . 0.0 112.122 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 53' ' ' SER . 11.9 p -136.36 146.77 28.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.838 0.352 . . . . 0.0 111.001 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -122.82 140.12 53.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.312 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -75.25 139.97 42.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.854 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.404 ' CE ' ' HB ' ' A' ' 8' ' ' ILE . 51.4 mtmt . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.855 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ptp . . . . . 0 N--CA 1.501 2.119 0 CA-C-O 120.99 0.424 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.4 p -74.51 150.42 39.82 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.238 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 84.9 tt0 -99.83 125.8 45.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.021 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -84.96 143.96 28.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.024 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.7 t -108.02 128.58 63.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.709 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.1 mt -107.32 115.52 48.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.197 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.797 HG12 ' HA ' ' A' ' 58' ' ' ARG . 21.5 m -128.83 161.09 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 120.881 0.372 . . . . 0.0 111.411 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.579 ' C ' HG23 ' A' ' 56' ' ' VAL . 16.2 mt -119.83 128.72 75.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.12 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.407 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -84.71 117.46 23.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.004 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -90.92 -3.71 57.1 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.515 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 15.9 m-90 -147.08 141.65 26.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.785 0.326 . . . . 0.0 110.377 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.2 p-10 -71.31 120.0 16.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.847 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.414 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 60.9 t80 -127.62 137.11 52.45 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.57 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 63.6 m -99.93 141.97 32.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.748 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.809 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.48 131.98 51.77 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.792 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -63.72 -30.94 71.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.118 0.485 . . . . 0.0 110.184 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -137.69 160.89 37.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.256 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -59.54 -35.07 73.51 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.935 0.398 . . . . 0.0 111.169 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -65.19 -20.11 66.29 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.282 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.809 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 3.0 mm-40 -83.79 -179.35 7.27 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.59 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.84 HD23 HG13 ' A' ' 41' ' ' VAL . 24.1 tp -120.57 140.53 51.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.028 0.442 . . . . 0.0 112.085 -178.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -84.2 146.45 27.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.65 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.564 HG22 ' HG ' ' A' ' 29' ' ' LEU . 45.3 pt -131.36 160.99 41.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.192 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -116.71 167.24 11.26 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.073 0.464 . . . . 0.0 111.386 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 52.1 pttt -67.21 -14.86 63.3 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.606 -0.725 . . . . 0.0 112.79 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -140.0 22.21 2.44 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.671 -0.411 . . . . 0.0 111.561 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.416 ' HG3' ' CD2' ' A' ' 29' ' ' LEU . 40.4 tp10 -99.67 135.42 41.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.899 0.38 . . . . 0.0 110.516 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.527 ' HG2' HG23 ' A' ' 8' ' ' ILE . 69.2 mtp180 -90.53 120.77 31.9 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.754 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.564 ' HG ' HG22 ' A' ' 23' ' ' ILE . 0.3 OUTLIER -115.69 148.0 40.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.577 -179.601 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.4 m-90 -101.62 109.77 21.63 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.079 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.456 ' HA ' HG23 ' A' ' 41' ' ' VAL . 0.2 OUTLIER -81.02 152.63 27.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.383 0.611 . . . . 0.0 112.255 -179.05 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.5 mp -110.93 -25.4 9.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.07 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -160.99 117.41 2.26 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 120.745 0.307 . . . . 0.0 111.067 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.416 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.5 p-10 -110.8 7.18 21.89 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 86.0 p -74.1 -36.57 64.25 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.82 0.343 . . . . 0.0 111.371 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -81.1 161.41 24.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.371 0.605 . . . . 0.0 112.31 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.454 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 17.6 p -57.55 -40.5 79.02 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.007 178.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.471 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 43.8 m95 -93.94 131.17 39.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.918 177.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.422 ' HB3' HD21 ' A' ' 31' ' ' LEU . 32.0 m0 -102.67 129.68 49.34 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.433 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 44.3 ttt180 -91.78 127.17 37.13 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.84 HG13 HD23 ' A' ' 21' ' ' LEU . 3.2 p -140.16 161.97 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -177.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.526 ' HA ' HG22 ' A' ' 48' ' ' THR . 59.9 ttt85 -126.23 145.51 50.37 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.723 0.297 . . . . 0.0 111.202 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.469 ' HB2' HD21 ' A' ' 21' ' ' LEU . 61.8 t30 -113.19 161.54 17.04 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.917 0.389 . . . . 0.0 111.824 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.98 -21.05 58.01 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.262 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.65 6.35 15.45 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 68.05 26.07 7.37 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 120.949 0.404 . . . . 0.0 111.26 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.527 ' O ' HD13 ' A' ' 21' ' ' LEU . 75.0 ttt180 -110.23 123.44 49.78 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.526 HG22 ' HA ' ' A' ' 42' ' ' ARG . 52.5 p -121.74 156.94 32.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.749 0.309 . . . . 0.0 111.208 -179.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.451 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -173.48 171.03 44.18 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.365 -0.922 . . . . 0.0 113.308 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.429 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 90.4 m-85 -103.54 112.53 25.49 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.747 0.308 . . . . 0.0 111.28 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.559 HG13 ' HB3' ' A' ' 20' ' ' GLU . 2.9 m -132.29 114.74 14.85 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.03 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.471 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 8.7 Cg_exo -73.63 36.99 0.4 Allowed 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.721 2.281 . . . . 0.0 113.026 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.466 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.2 OUTLIER -67.69 92.98 0.35 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 120.865 0.364 . . . . 0.0 111.267 -179.584 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -62.17 -17.55 58.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.281 178.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.515 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.0 m-85 -59.93 -14.82 17.48 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.579 HG23 ' C ' ' A' ' 8' ' ' ILE . 8.1 p -112.72 140.44 32.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.083 0.468 . . . . 0.0 110.835 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -136.82 165.24 26.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.064 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.797 ' HA ' HG12 ' A' ' 7' ' ' VAL . 92.0 mtt180 -69.55 139.43 53.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.915 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.7 pttp . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.738 179.977 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.7 mtm . . . . . 0 N--CA 1.501 2.096 0 CA-C-O 120.905 0.383 . . . . 0.0 111.666 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.415 HG22 ' H ' ' A' ' 4' ' ' GLU . 90.8 m -82.13 131.23 35.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.864 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -61.75 -35.81 79.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.02 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.415 ' H ' HG22 ' A' ' 2' ' ' THR . 98.4 mt-10 -69.67 139.12 53.46 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.936 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.478 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.1 t -110.35 130.02 64.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.627 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.8 mt -111.67 118.32 57.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.673 0.273 . . . . 0.0 111.709 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.6 HG12 ' HA ' ' A' ' 58' ' ' ARG . 21.4 m -134.11 160.67 41.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.034 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.467 ' HA ' ' HA ' ' A' ' 28' ' ' ARG . 33.6 mt -121.07 124.05 71.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.312 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.76 125.2 28.61 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.932 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.1 mttm -90.99 -9.24 46.72 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.58 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 12.5 m-90 -146.64 145.98 30.24 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.867 0.365 . . . . 0.0 110.876 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -69.91 125.23 26.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.995 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.455 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 65.6 t80 -127.81 141.16 51.65 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.502 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -104.19 136.66 43.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.922 0.392 . . . . 0.0 110.897 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.699 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.26 133.04 54.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.384 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -65.77 -34.27 77.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.187 0.518 . . . . 0.0 110.182 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -131.83 163.94 27.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.329 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -63.52 -31.15 72.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.864 0.364 . . . . 0.0 111.335 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -63.38 -27.25 69.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.301 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.699 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -82.6 -179.19 7.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.27 179.755 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.518 HD21 ' O ' ' A' ' 47' ' ' ARG . 6.4 mp -124.73 143.89 50.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.007 0.432 . . . . 0.0 111.345 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -81.44 148.78 29.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.407 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.455 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 49.8 pt -130.96 162.89 38.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.262 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -116.29 171.51 7.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.811 0.339 . . . . 0.0 110.873 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.459 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 16.1 ptpt -69.45 -10.99 60.42 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.7 p-10 -138.46 25.32 2.65 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.714 -0.395 . . . . 0.0 111.366 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.413 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 78.6 tt0 -101.08 139.16 37.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.783 0.325 . . . . 0.0 111.162 -179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.555 ' C ' HD22 ' A' ' 29' ' ' LEU . 35.8 ptt180 -99.01 121.25 40.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.95 0.405 . . . . 0.0 111.305 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.555 HD22 ' C ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -115.28 153.98 29.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.555 -179.564 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.5 m-90 -101.96 112.31 24.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.687 0.28 . . . . 0.0 111.517 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.478 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 40.2 mt -78.19 145.03 35.82 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.928 0.394 . . . . 0.0 111.455 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.8 mp -111.27 -27.09 8.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.324 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -157.52 115.93 3.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.853 0.359 . . . . 0.0 111.038 -179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.458 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -107.14 4.14 26.5 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.3 t -68.94 -36.66 78.22 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.865 0.364 . . . . 0.0 111.441 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -81.83 159.18 23.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.859 -179.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 86.1 m -59.82 -35.66 75.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.194 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.527 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 8.8 m0 -99.99 125.2 45.99 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.458 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 42.5 m0 -94.96 138.44 32.69 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.429 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 66.6 ttt180 -91.83 137.54 32.28 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.555 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -140.4 161.44 24.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.619 -0.433 . . . . 0.0 112.134 -178.146 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.484 ' HB2' HG22 ' A' ' 48' ' ' THR . 46.1 ttp180 -123.48 143.88 49.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.784 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -111.2 162.88 14.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.431 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.9 -19.89 20.23 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.739 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -81.25 6.0 15.43 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 69.96 24.77 5.05 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-O 120.786 0.327 . . . . 0.0 110.983 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.518 ' O ' HD21 ' A' ' 21' ' ' LEU . 62.7 ttt180 -111.09 128.77 55.99 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.048 179.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.484 HG22 ' HB2' ' A' ' 42' ' ' ARG . 72.8 p -116.91 156.82 26.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.926 0.393 . . . . 0.0 111.16 -179.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -171.59 178.4 43.91 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.038 -0.601 . . . . 0.0 112.087 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.429 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 97.1 m-85 -106.86 112.31 25.22 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.924 0.392 . . . . 0.0 111.109 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.503 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.7 t -124.54 112.16 27.7 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.658 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.527 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 7.5 Cg_exo -72.9 36.6 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.514 2.143 . . . . 0.0 112.759 178.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.485 ' O ' HG12 ' A' ' 56' ' ' VAL . 61.9 p -65.06 97.72 0.26 Allowed 'General case' 0 N--CA 1.443 -0.805 0 CA-C-O 120.599 0.238 . . . . 0.0 110.899 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -80.73 -3.68 51.7 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.078 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.58 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 81.1 m-85 -76.74 -1.61 28.88 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 53' ' ' SER . 7.3 p -111.66 142.03 25.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 121.076 0.465 . . . . 0.0 110.859 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -125.86 145.4 50.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.028 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.6 ' HA ' HG12 ' A' ' 7' ' ' VAL . 64.6 mtp180 -69.3 135.69 50.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.962 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.438 ' HD2' HD12 ' A' ' 8' ' ' ILE . 53.2 mttp . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.282 -0.866 . . . . 0.0 110.865 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttm . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.888 0.375 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 68.8 p -75.32 149.11 38.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.984 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -102.12 131.29 48.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.123 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -75.25 139.28 42.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.506 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.6 t -116.99 129.38 73.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.362 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.3 mt -117.54 123.53 71.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.638 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.698 HG12 ' HA ' ' A' ' 58' ' ' ARG . 29.8 m -134.37 159.6 41.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.221 0.534 . . . . 0.0 112.053 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.779 HG23 ' HG2' ' A' ' 28' ' ' ARG . 24.2 mt -117.15 127.13 74.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.093 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.691 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.38 148.72 43.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.95 -179.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -113.85 -16.48 12.23 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.589 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.509 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 11.6 m-90 -145.21 148.39 33.48 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.913 0.387 . . . . 0.0 110.325 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -68.49 126.51 29.87 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.667 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.425 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 45.7 t80 -127.25 135.78 51.09 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.163 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.3 m -105.52 120.77 42.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.026 0.441 . . . . 0.0 110.081 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.514 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -52.92 143.46 16.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.048 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -129.51 40.45 3.59 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.185 0.517 . . . . 0.0 111.473 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.521 ' H ' ' HG2' ' A' ' 20' ' ' GLU . 86.8 mm-40 -135.52 176.41 8.7 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.861 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -78.24 -38.68 42.41 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -122.95 77.69 1.48 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.218 0.532 . . . . 0.0 109.94 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.672 ' C ' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -138.95 -179.39 5.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.408 -177.715 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.802 HD11 ' HG2' ' A' ' 47' ' ' ARG . 8.9 mp -137.01 137.39 39.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.101 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.9 p-10 -80.18 150.07 30.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.995 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 46.4 pt -129.44 164.17 32.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 120.655 0.264 . . . . 0.0 110.7 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -112.91 -177.59 3.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.28 0.562 . . . . 0.0 111.451 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -61.44 -52.25 65.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.827 -178.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -105.91 -7.89 17.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.418 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 80.5 tt0 -54.67 146.21 17.3 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.789 0.328 . . . . 0.0 111.515 -179.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.779 ' HG2' HG23 ' A' ' 8' ' ' ILE . 82.4 mtm180 -107.32 125.48 51.23 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.446 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.571 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -116.26 156.24 26.94 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 120.796 0.331 . . . . 0.0 110.738 179.737 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.466 ' O ' HD22 ' A' ' 32' ' ' LEU . 5.7 m-90 -104.68 106.61 17.18 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.647 179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.546 ' HA ' HG23 ' A' ' 41' ' ' VAL . 25.9 mt -68.53 143.42 54.94 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.513 0.673 . . . . 0.0 112.13 -178.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.596 HD23 ' HA ' ' A' ' 41' ' ' VAL . 3.9 mm? -112.48 -35.86 5.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.631 -178.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -157.15 115.33 3.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.432 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.444 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 38.4 p-10 -111.99 4.31 18.04 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.3 m -67.47 -39.3 85.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.791 0.329 . . . . 0.0 111.606 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -81.27 159.59 24.45 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.782 -179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.84 -35.24 68.61 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.473 ' CE3' ' HG3' ' A' ' 52' ' ' PRO . 16.8 m95 -96.22 131.18 42.97 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 177.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.472 ' CZ3' HD11 ' A' ' 31' ' ' LEU . 37.7 m0 -104.07 135.44 45.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.168 0.509 . . . . 0.0 112.313 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 49' ' ' GLY . 75.2 ttt180 -94.65 130.29 41.19 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.596 ' HA ' HD23 ' A' ' 32' ' ' LEU . 1.4 p -137.03 157.3 35.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.443 ' HB2' HD21 ' A' ' 32' ' ' LEU . 37.8 ttm180 -120.55 141.58 50.13 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.075 -178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -113.18 163.18 15.09 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.676 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.73 -18.94 5.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.17 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.43 6.43 10.24 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 66.05 26.1 10.81 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.052 0.453 . . . . 0.0 111.043 -179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.802 ' HG2' HD11 ' A' ' 21' ' ' LEU . 56.7 ttp180 -112.32 143.55 43.24 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.463 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.404 HG22 ' CB ' ' A' ' 42' ' ' ARG . 73.1 p -132.76 161.61 33.61 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.982 -0.287 . . . . 0.0 110.791 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.649 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -177.81 -176.34 45.74 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.966 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.438 ' O ' ' HB3' ' A' ' 20' ' ' GLU . 93.6 m-85 -110.69 115.19 29.14 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.712 1.004 . . . . 0.0 113.712 -178.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 51' ' ' VAL . 4.4 m -137.91 112.75 8.97 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.971 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.473 ' HG3' ' CE3' ' A' ' 38' ' ' TRP . 2.7 Cg_exo -74.77 56.35 4.09 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.145 1.897 . . . . 0.0 111.371 178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.771 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -73.08 82.24 1.27 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.073 0.463 . . . . 0.0 111.707 -178.83 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -64.64 -14.78 59.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.638 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.509 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.6 m-85 -71.1 -7.17 44.72 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.771 HG12 ' O ' ' A' ' 53' ' ' SER . 9.3 p -110.03 146.58 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.94 0.4 . . . . 0.0 110.888 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -136.59 162.43 33.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.506 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.698 ' HA ' HG12 ' A' ' 7' ' ' VAL . 77.5 mtp180 -69.39 140.89 54.22 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.771 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.979 179.853 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.3 mtm . . . . . 0 N--CA 1.498 1.95 0 CA-C-O 120.843 0.354 . . . . 0.0 111.754 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 65.1 m -80.0 137.95 36.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.922 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -80.75 134.33 35.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.999 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -100.32 138.39 37.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.418 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.495 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 57.9 t -115.34 133.7 60.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.251 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.1 mt -103.11 119.25 51.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.665 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.665 HG12 ' HA ' ' A' ' 58' ' ' ARG . 35.1 m -132.29 160.24 42.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.564 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.687 ' C ' HG23 ' A' ' 56' ' ' VAL . 26.0 mm -118.48 123.96 72.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.922 0.392 . . . . 0.0 111.329 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.527 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -76.38 120.52 21.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.514 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -93.01 -6.74 47.64 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.594 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 6.8 m-90 -143.99 143.78 31.37 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.796 0.331 . . . . 0.0 110.399 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -71.38 121.66 18.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.048 0.451 . . . . 0.0 111.722 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.433 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 54.2 t80 -127.18 135.52 50.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.692 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.4 m -102.73 141.73 35.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.016 0.436 . . . . 0.0 110.93 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.631 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.76 135.17 51.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.675 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -84.97 -4.87 59.31 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.697 0.284 . . . . 0.0 110.959 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.438 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 74.9 mt-30 -143.9 171.73 13.83 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -76.37 -28.79 56.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.894 0.378 . . . . 0.0 111.775 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -81.36 -6.7 59.19 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.631 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.1 mt-10 -86.04 179.09 7.04 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.736 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.857 HD23 HG13 ' A' ' 41' ' ' VAL . 28.8 tp -124.27 126.57 46.29 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.997 0.427 . . . . 0.0 111.672 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -68.95 149.51 48.76 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.027 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.597 HG22 ' HG ' ' A' ' 29' ' ' LEU . 46.4 pt -134.88 165.24 31.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.249 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -118.88 166.97 12.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.055 0.455 . . . . 0.0 111.353 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.414 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 55.4 pttt -67.22 -12.56 60.38 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -139.73 21.4 2.5 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.364 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 -97.88 141.15 31.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.901 0.381 . . . . 0.0 110.636 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.567 ' HB3' HD12 ' A' ' 8' ' ' ILE . 35.9 ptt-85 -98.72 120.63 39.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.571 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.67 HD22 ' N ' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -113.75 148.17 36.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.032 0.444 . . . . 0.0 111.693 -178.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 15.8 m-90 -99.83 111.31 23.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.979 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.495 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 62.4 mt -72.95 147.32 45.35 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.809 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.777 HD13 ' HG2' ' A' ' 40' ' ' ARG . 5.2 mp -109.51 -30.89 7.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.415 -179.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -133.72 -66.37 0.64 Allowed 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 120.809 0.338 . . . . 0.0 111.483 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.466 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 3.2 p30 51.6 16.41 0.45 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.621 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.6 m -77.93 -35.87 50.01 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.912 0.387 . . . . 0.0 110.89 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.4 mmtt -92.34 175.3 6.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.646 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.9 m -59.15 -27.86 66.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.723 178.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.489 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 49.4 m95 -99.75 127.64 45.88 Favored 'General case' 0 CA--C 1.522 -0.114 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 177.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.466 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 38.4 m0 -108.23 128.51 54.78 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.78 1.03 . . . . 0.0 113.78 -176.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.777 ' HG2' HD13 ' A' ' 32' ' ' LEU . 23.5 ttm180 -87.84 135.94 33.17 Favored 'General case' 0 C--O 1.231 0.087 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 177.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.857 HG13 HD23 ' A' ' 21' ' ' LEU . 1.4 p -145.36 161.9 12.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.221 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HA ' HG22 ' A' ' 48' ' ' THR . 65.5 ttt180 -120.84 144.06 48.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.009 0.433 . . . . 0.0 111.606 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.855 ' HB2' HD21 ' A' ' 21' ' ' LEU . 55.9 t30 -114.33 161.12 18.31 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.319 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.38 -20.39 29.25 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.816 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.85 6.4 13.24 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 67.69 26.02 7.99 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.062 0.458 . . . . 0.0 111.121 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.633 ' O ' HD13 ' A' ' 21' ' ' LEU . 85.6 mtt-85 -111.72 128.54 56.12 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.647 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.444 HG22 ' HA ' ' A' ' 42' ' ' ARG . 30.5 p -125.61 151.4 46.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.336 -179.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.551 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -172.47 172.64 45.04 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.685 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.467 ' CE1' ' HB2' ' A' ' 40' ' ' ARG . 52.6 m-85 -96.75 108.55 21.22 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.48 HG13 ' HB3' ' A' ' 20' ' ' GLU . 4.2 m -126.91 111.36 22.06 Favored Pre-proline 0 C--N 1.333 -0.116 0 CA-C-N 116.794 -0.185 . . . . 0.0 111.208 178.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.489 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 60.5 Cg_endo -72.23 46.46 0.93 Allowed 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 121.788 1.659 . . . . 0.0 111.733 178.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.68 ' O ' HG12 ' A' ' 56' ' ' VAL . 9.1 p -72.99 81.62 1.21 Allowed 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 120.973 0.416 . . . . 0.0 111.112 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 p30 -58.05 -19.45 31.67 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.113 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.594 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 90.6 m-85 -57.22 -16.92 9.36 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.724 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.687 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.2 p -108.98 140.57 27.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.045 0.45 . . . . 0.0 110.859 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -135.42 162.56 32.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.026 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.665 ' HA ' HG12 ' A' ' 7' ' ' VAL . 41.1 ttm180 -70.08 139.14 52.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.912 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.3 tttp . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.953 -179.929 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.0 mtm . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 120.79 0.329 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.0 t -97.38 137.69 35.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.468 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -94.38 138.0 32.86 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.869 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -99.26 139.01 35.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.288 0.566 . . . . 0.0 111.711 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.412 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 53.2 t -118.25 128.29 75.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.428 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.1 mt -109.81 119.79 59.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.249 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.628 HG12 ' CA ' ' A' ' 58' ' ' ARG . 34.1 m -134.03 161.11 41.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.85 0.357 . . . . 0.0 111.244 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.669 HD12 ' HG2' ' A' ' 28' ' ' ARG . 17.2 mm -115.89 121.95 68.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.034 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.573 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -76.12 126.77 31.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.722 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -99.67 -10.6 21.76 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.596 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.3 m-90 -141.96 145.26 34.3 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.839 0.352 . . . . 0.0 110.462 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -72.53 122.64 21.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.627 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.422 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 55.8 t80 -127.71 139.03 52.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.723 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.3 m -103.14 134.47 46.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.001 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.76 ' HB1' ' HG3' ' A' ' 20' ' ' GLU . . . -56.43 142.26 39.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.965 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -88.75 -4.56 58.49 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -149.45 176.95 10.15 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.637 0.256 . . . . 0.0 110.662 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -75.78 -34.18 60.2 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.127 0.489 . . . . 0.0 110.694 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -62.45 -35.98 81.0 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.146 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.894 ' HB2' HG13 ' A' ' 51' ' ' VAL . 0.9 OUTLIER -81.7 178.61 8.23 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.469 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.57 ' O ' HG11 ' A' ' 51' ' ' VAL . 10.2 mp -126.12 161.33 27.88 Favored 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 121.32 0.581 . . . . 0.0 112.093 -178.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -90.53 148.1 22.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.162 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.5 HG22 HD11 ' A' ' 29' ' ' LEU . 40.2 pt -130.06 163.21 36.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.441 ' HB3' ' HB2' ' A' ' 27' ' ' GLU . 86.4 tttt -117.72 164.54 14.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.991 0.424 . . . . 0.0 111.277 -178.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.439 ' N ' ' HG2' ' A' ' 24' ' ' LYS . 11.0 ptpp? -63.31 -12.89 33.01 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 -179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -137.75 5.55 2.64 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 24' ' ' LYS . 77.1 tt0 -77.27 146.79 36.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.753 0.311 . . . . 0.0 110.599 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.669 ' HG2' HD12 ' A' ' 8' ' ' ILE . 86.3 mtm180 -94.96 119.64 33.83 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 120.979 0.418 . . . . 0.0 110.875 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.608 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.6 mm? -113.77 142.41 46.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.468 -179.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -103.32 109.63 21.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.695 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.412 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 90.6 mt -79.68 151.12 30.67 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.312 0.577 . . . . 0.0 111.67 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -114.99 -29.01 6.82 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.804 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -161.4 118.36 2.23 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.363 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.456 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.1 p-10 -110.33 2.89 19.38 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.6 m -63.58 -38.9 92.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.955 0.407 . . . . 0.0 111.367 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -82.8 159.49 22.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.675 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -58.08 -35.6 71.62 Favored 'General case' 0 C--O 1.23 0.065 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.448 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 45.1 m95 -94.85 132.05 40.08 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.456 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 40.1 m0 -105.9 132.47 51.97 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -177.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -86.87 131.96 33.96 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.608 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.6 p -140.7 159.56 24.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -177.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.503 ' CB ' HG22 ' A' ' 48' ' ' THR . 44.2 ttm180 -123.79 141.78 51.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.568 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -110.38 162.26 14.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.588 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.36 -19.93 39.57 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.587 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.79 5.01 14.67 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.022 0.378 . . . . 0.0 112.022 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.8 t30 71.88 26.4 2.96 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 110.886 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.443 ' HB2' HD21 ' A' ' 21' ' ' LEU . 99.5 mtt180 -112.47 133.98 54.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.127 179.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.503 HG22 ' CB ' ' A' ' 42' ' ' ARG . 73.5 p -124.58 148.1 48.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.901 0.381 . . . . 0.0 111.205 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.715 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -163.23 -178.67 37.17 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.628 -179.468 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 92.0 m-85 -113.27 97.05 6.24 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.894 HG13 ' HB2' ' A' ' 20' ' ' GLU . 0.2 OUTLIER -112.97 121.11 39.13 Favored Pre-proline 0 C--N 1.329 -0.315 0 C-N-CA 121.341 -0.144 . . . . 0.0 110.753 178.288 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.448 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 96.0 Cg_endo -78.26 43.33 1.39 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.018 1.812 . . . . 0.0 111.697 177.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.563 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -71.01 87.84 0.75 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.868 0.366 . . . . 0.0 111.343 -179.292 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -68.32 -11.63 59.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.524 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.596 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 98.7 m-85 -69.09 -10.47 57.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.573 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.3 p -114.86 141.49 31.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.996 0.427 . . . . 0.0 110.691 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -146.88 161.58 40.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.858 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.628 ' CA ' HG12 ' A' ' 7' ' ' VAL . 79.5 ttt-85 -69.84 138.84 52.92 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.881 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.527 ' HG2' ' HG2' ' A' ' 58' ' ' ARG . 74.6 mmtt . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.916 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.1 mtp . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 120.839 0.352 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 76.1 p -75.19 157.6 34.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.832 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -72.86 -27.77 62.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.025 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -103.98 128.39 51.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.831 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.421 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 55.2 t -107.86 132.28 55.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.472 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.0 mm -97.05 118.45 43.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.166 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.833 HG12 ' HA ' ' A' ' 58' ' ' ARG . 30.5 m -134.33 162.86 38.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.184 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.78 HD12 ' HG2' ' A' ' 28' ' ' ARG . 26.8 mm -120.96 130.38 74.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.035 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.18 150.92 38.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.844 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -117.09 -14.17 10.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.748 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.402 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 8.6 m-90 -148.69 149.98 32.4 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.93 0.395 . . . . 0.0 110.962 -179.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -74.18 121.92 21.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.14 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -127.4 137.43 52.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.997 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.3 m -99.76 137.32 38.4 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.287 179.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.653 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -51.19 129.57 24.64 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.927 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -62.4 -23.74 67.0 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.985 0.422 . . . . 0.0 110.449 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.455 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 96.1 mt-30 -139.47 172.91 12.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.071 179.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -72.8 -29.39 63.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.926 0.393 . . . . 0.0 111.482 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -72.12 -17.46 61.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.911 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.653 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -86.22 179.61 6.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.725 0.298 . . . . 0.0 110.327 -179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 43' ' ' ASN . 15.3 tp -118.9 143.57 46.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.22 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -86.0 151.66 23.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.654 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 33.7 pt -134.07 162.48 39.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.73 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -114.22 -176.95 3.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.195 0.522 . . . . 0.0 111.24 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 26.1 mttt -63.56 -52.95 58.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.427 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -109.1 -0.17 19.55 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -57.4 142.48 43.65 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 120.943 0.401 . . . . 0.0 111.404 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.78 ' HG2' HD12 ' A' ' 8' ' ' ILE . 92.5 mtt180 -94.7 122.29 37.16 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.343 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.641 ' HB3' HG21 ' A' ' 41' ' ' VAL . 3.8 mm? -111.38 145.43 38.9 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 26.6 m-90 -105.47 108.44 19.95 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.554 179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.535 HD23 HG23 ' A' ' 41' ' ' VAL . 68.1 mt -72.16 147.42 46.63 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.071 0.463 . . . . 0.0 111.891 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.4 mp -112.6 -28.52 7.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.255 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -158.51 116.41 2.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.804 0.335 . . . . 0.0 111.101 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.445 ' OD2' HD13 ' A' ' 31' ' ' LEU . 96.4 m-20 -110.08 9.12 24.15 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.195 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 87.9 p -77.19 -35.13 56.06 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.923 0.392 . . . . 0.0 110.99 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -82.79 157.44 23.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.424 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -58.44 -36.78 74.18 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.428 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 15.2 m95 -95.51 130.17 42.44 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 177.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.422 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 32.3 m0 -100.91 134.41 43.94 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.16 0.505 . . . . 0.0 112.277 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.451 ' HA ' ' HA ' ' A' ' 50' ' ' TYR . 73.5 ttt180 -92.79 133.06 36.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 177.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.641 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.2 p -140.48 147.05 23.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 C-N-CA 120.621 -0.432 . . . . 0.0 111.929 -177.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.406 ' CB ' ' HB ' ' A' ' 48' ' ' THR . 58.8 ttt180 -118.54 153.3 34.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.653 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.763 ' HB3' HD21 ' A' ' 21' ' ' LEU . 53.4 p-10 -122.49 171.8 8.83 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.033 0.444 . . . . 0.0 111.808 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.36 -15.08 46.34 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.174 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.88 6.08 10.01 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 66.32 23.18 10.76 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.885 0.374 . . . . 0.0 111.269 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.601 ' O ' HD13 ' A' ' 21' ' ' LEU . 66.9 mtt180 -119.53 129.41 54.67 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.406 ' HB ' ' CB ' ' A' ' 42' ' ' ARG . 5.7 t -135.99 155.85 49.63 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.684 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.528 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.81 -173.66 36.06 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 120.628 -0.796 . . . . 0.0 113.021 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.451 ' HA ' ' HA ' ' A' ' 40' ' ' ARG . 98.1 m-85 -99.66 107.62 19.78 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.69 HG21 ' O ' ' A' ' 21' ' ' LEU . 20.5 t -125.56 119.83 24.6 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.276 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.428 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 77.4 Cg_endo -83.21 39.63 0.84 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.217 1.945 . . . . 0.0 111.733 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.632 ' O ' HG12 ' A' ' 56' ' ' VAL . 25.6 p -68.5 90.05 0.37 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.877 0.37 . . . . 0.0 111.617 -179.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -65.94 -13.59 60.04 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.45 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -60.22 -14.4 17.49 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.632 HG12 ' O ' ' A' ' 53' ' ' SER . 7.7 p -111.08 147.16 15.29 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 120.847 0.356 . . . . 0.0 110.759 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -146.07 164.9 30.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.64 -179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.833 ' HA ' HG12 ' A' ' 7' ' ' VAL . 91.9 mtm-85 -68.4 141.86 55.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.332 . . . . 0.0 110.562 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.249 -0.881 . . . . 0.0 110.969 179.959 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.535 ' O ' HG22 ' A' ' 2' ' ' THR . 98.2 mtp . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.843 0.354 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 1' ' ' MET . 11.4 t 48.45 36.09 6.78 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.968 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -92.24 132.5 36.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.83 0.348 . . . . 0.0 111.215 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -82.02 148.75 28.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.083 0.468 . . . . 0.0 111.0 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 68.5 t -115.05 130.25 69.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.698 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.434 HG23 ' CD1' ' A' ' 30' ' ' TRP . 25.4 mt -112.87 119.0 59.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.848 0.356 . . . . 0.0 111.403 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.618 HG12 ' HA ' ' A' ' 58' ' ' ARG . 34.2 m -132.68 161.65 41.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.07 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.64 ' C ' HG23 ' A' ' 56' ' ' VAL . 30.7 mt -117.43 129.38 74.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-O 120.957 0.408 . . . . 0.0 111.339 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.619 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.85 148.29 38.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.362 -179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -113.31 -17.81 12.21 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.693 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.472 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.9 m-90 -143.62 134.54 25.4 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.965 0.412 . . . . 0.0 111.014 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 35.7 p-10 -60.04 125.32 23.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.626 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -127.54 141.32 51.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.982 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 86.8 m -106.38 138.35 42.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.404 179.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.618 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.92 132.27 49.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.728 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -66.79 -24.67 66.21 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.138 0.494 . . . . 0.0 110.58 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.409 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 96.3 mt-30 -136.12 170.67 15.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.103 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -72.46 -28.11 62.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.79 0.328 . . . . 0.0 111.168 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -69.96 -21.2 63.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.794 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.618 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -82.9 -179.24 7.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.839 0.352 . . . . 0.0 110.556 179.901 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.78 HD21 ' HB3' ' A' ' 43' ' ' ASN . 11.7 tp -118.1 139.92 50.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.323 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -83.54 140.67 32.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.422 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.416 HG22 HD11 ' A' ' 29' ' ' LEU . 32.3 pt -126.56 165.39 24.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.53 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.4 mttm -114.35 -178.68 3.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.12 0.486 . . . . 0.0 111.523 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -64.01 -52.14 60.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.572 -0.74 . . . . 0.0 112.396 -178.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -106.44 -6.42 18.21 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -57.78 146.75 30.36 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.918 0.39 . . . . 0.0 111.022 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.604 ' HG2' HG23 ' A' ' 8' ' ' ILE . 23.7 mtm105 -101.3 124.86 47.66 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.875 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.533 HD22 ' C ' ' A' ' 28' ' ' ARG . 1.3 mm? -114.32 149.78 35.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.157 0.503 . . . . 0.0 111.644 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.434 ' CD1' HG23 ' A' ' 6' ' ' ILE . 5.2 m-90 -102.17 115.73 31.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.419 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.709 ' C ' HD23 ' A' ' 32' ' ' LEU . 40.6 mt -79.88 146.22 32.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.367 0.603 . . . . 0.0 112.337 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.709 HD23 ' C ' ' A' ' 31' ' ' LEU . 1.7 mt -108.94 -35.0 6.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.308 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -159.61 117.59 2.73 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.11 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.442 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.8 p-10 -107.41 4.94 26.84 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.163 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.9 m -69.11 -36.56 77.67 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.776 0.322 . . . . 0.0 111.696 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -84.06 156.84 22.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.101 0.477 . . . . 0.0 112.035 -179.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 60.2 m -55.75 -31.29 62.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.368 177.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.2 m95 -101.59 134.25 45.01 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.442 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.5 m0 -103.82 138.01 41.02 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -97.13 130.45 44.39 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.526 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.5 OUTLIER -139.56 148.62 23.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 120.59 -0.444 . . . . 0.0 112.023 -177.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -122.99 146.53 47.54 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.886 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.78 ' HB3' HD21 ' A' ' 21' ' ' LEU . 52.3 p-10 -113.44 171.2 7.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.038 0.447 . . . . 0.0 112.022 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.22 -16.2 31.37 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.991 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -80.61 5.04 16.61 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 69.93 22.09 6.0 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.75 0.309 . . . . 0.0 111.143 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -116.46 128.62 55.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.11 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.5 t -134.04 151.46 51.43 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.318 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.445 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -160.77 -173.43 29.36 Favored Glycine 0 CA--C 1.521 0.408 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.807 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -100.06 104.55 16.13 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.766 0.317 . . . . 0.0 111.106 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.57 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.3 t -123.88 112.29 28.84 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.023 179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.8 44.34 1.27 Allowed 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 121.794 1.662 . . . . 0.0 111.437 177.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.648 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.9 p -72.92 81.97 1.2 Allowed 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 120.88 0.371 . . . . 0.0 111.467 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -64.76 -13.36 54.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.338 177.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.472 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.9 m-85 -62.94 -10.92 15.35 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 53' ' ' SER . 7.3 p -108.82 141.78 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-O 121.05 0.453 . . . . 0.0 111.033 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -130.17 158.46 39.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.651 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.618 ' HA ' HG12 ' A' ' 7' ' ' VAL . 24.3 ttm105 -70.22 129.65 39.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.925 0.393 . . . . 0.0 111.25 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.251 179.723 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.0 mtp . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.86 0.362 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.6 m -79.82 132.24 36.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.923 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -98.48 124.38 43.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.021 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -98.94 137.25 37.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.195 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.55 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 99.6 t -116.64 133.01 64.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.586 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.2 mt -101.08 119.12 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.877 0.37 . . . . 0.0 111.235 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.626 HG12 ' HA ' ' A' ' 58' ' ' ARG . 34.9 m -131.96 163.03 38.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.545 179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.647 HG23 ' HG2' ' A' ' 28' ' ' ARG . 47.3 mt -122.89 127.59 74.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.77 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.566 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.08 145.25 44.57 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.952 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -108.83 -18.01 13.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.887 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.533 ' HA ' ' HD3' ' A' ' 25' ' ' LYS . 9.7 m-90 -143.87 147.54 34.19 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.844 0.354 . . . . 0.0 111.595 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.495 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 60.5 t0 -69.89 123.14 20.73 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.179 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.425 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 65.1 t80 -128.52 134.88 48.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.666 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 92.6 m -99.5 140.97 32.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.413 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.674 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -53.37 131.49 37.87 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.599 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -67.41 -18.32 65.07 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.384 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.46 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 93.0 mt-30 -142.6 173.7 11.3 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -76.24 -22.27 55.36 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.678 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -82.11 -7.04 59.6 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.674 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.1 mt-10 -92.88 -179.96 5.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.92 0.39 . . . . 0.0 110.744 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.969 HD23 HG13 ' A' ' 41' ' ' VAL . 46.3 tp -116.59 140.51 49.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.554 -178.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -85.62 150.06 24.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.837 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.425 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 31.2 pt -134.71 164.1 34.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.339 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -116.13 -175.87 2.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.916 0.389 . . . . 0.0 111.486 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.533 ' HD3' ' HA ' ' A' ' 11' ' ' TRP . 13.9 mmtt -64.67 -48.17 75.72 Favored 'General case' 0 C--N 1.334 -0.097 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -112.8 -4.72 13.96 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 73.0 tt0 -58.51 143.03 47.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.905 0.384 . . . . 0.0 111.422 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.647 ' HG2' HG23 ' A' ' 8' ' ' ILE . 90.7 mtt180 -99.74 126.12 45.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.628 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.582 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.3 mm? -114.67 146.45 40.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.002 0.429 . . . . 0.0 111.731 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -103.5 107.03 17.7 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.268 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.55 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 66.3 mt -72.9 148.54 44.26 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.117 0.485 . . . . 0.0 111.652 -179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -111.97 -29.01 7.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.023 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -158.97 116.97 2.86 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.52 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.454 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 36.6 p-10 -111.26 9.31 21.71 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 60.2 p -70.28 -36.71 74.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.919 0.39 . . . . 0.0 111.181 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -85.13 155.93 21.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.557 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.81 -35.39 61.36 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.5 m95 -95.62 135.34 37.43 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 177.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.454 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 41.9 m0 -109.13 133.17 53.36 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -177.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.433 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 46.4 ttt180 -87.53 134.44 33.61 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.969 HG13 HD23 ' A' ' 21' ' ' LEU . 1.5 p -145.78 157.35 12.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.824 -178.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.41 ' CB ' HG22 ' A' ' 48' ' ' THR . 37.8 ttm180 -121.27 143.46 49.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.389 -179.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.828 ' HB2' HD21 ' A' ' 21' ' ' LEU . 54.3 t30 -113.49 161.74 16.99 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.372 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.94 -21.33 29.25 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.546 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.76 5.76 10.54 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.9 m120 68.54 23.73 7.24 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-O 120.841 0.353 . . . . 0.0 111.046 -179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.509 ' O ' HD13 ' A' ' 21' ' ' LEU . 40.9 ttm180 -108.86 128.54 55.0 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.121 -0.491 . . . . 0.0 109.816 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.41 HG22 ' CB ' ' A' ' 42' ' ' ARG . 81.7 p -119.67 150.41 40.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.067 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.461 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -169.23 171.68 43.14 Favored Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.459 -0.876 . . . . 0.0 113.217 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.5 m-85 -102.68 106.37 17.0 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.574 0.225 . . . . 0.0 111.493 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.698 HG11 ' O ' ' A' ' 21' ' ' LEU . 11.1 m -123.08 119.21 27.8 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.327 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -77.31 33.11 0.43 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.147 1.898 . . . . 0.0 112.067 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.8 p -59.1 100.78 0.08 Allowed 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.644 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -81.4 -4.65 56.39 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.16 177.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -72.65 -7.61 51.21 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.538 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.601 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.7 p -118.81 142.43 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 CA-C-O 120.936 0.398 . . . . 0.0 110.563 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -141.32 161.22 38.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.754 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.626 ' HA ' HG12 ' A' ' 7' ' ' VAL . 27.5 ttm180 -69.93 134.72 48.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.027 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.518 ' HD2' HD12 ' A' ' 8' ' ' ILE . 79.8 tttt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.791 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.2 mtm . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.883 0.373 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.1 p -75.99 156.34 34.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.05 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -95.43 131.11 41.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.928 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -100.89 140.3 35.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.069 0.461 . . . . 0.0 111.421 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.481 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.0 t -117.87 132.61 67.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.304 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mm -103.21 109.86 28.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.414 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.416 HG12 ' CA ' ' A' ' 58' ' ' ARG . 13.1 m -128.85 162.23 36.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-O 120.771 0.319 . . . . 0.0 111.444 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.591 ' C ' HG23 ' A' ' 56' ' ' VAL . 22.8 mt -124.06 122.89 65.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.821 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.59 117.03 17.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.391 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -91.53 -5.35 54.27 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.572 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.2 m-90 -144.65 142.04 29.81 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.906 0.384 . . . . 0.0 110.528 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -70.09 120.39 15.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.584 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.432 ' HB3' HD11 ' A' ' 23' ' ' ILE . 49.4 t80 -127.27 134.13 50.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.556 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.3 m -101.25 141.95 33.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.942 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.662 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.06 135.56 56.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.703 -179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -83.27 -4.52 58.51 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.074 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.04 168.47 19.93 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.071 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -73.82 -35.34 64.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.443 . . . . 0.0 112.171 -178.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -76.15 -9.72 58.85 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.877 -0.601 . . . . 0.0 112.346 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.662 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -82.4 -178.52 7.09 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.008 0.432 . . . . 0.0 110.855 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.824 HD21 ' HB2' ' A' ' 43' ' ' ASN . 8.9 tp -122.82 138.94 54.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.79 -178.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -83.0 149.08 27.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.439 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.528 HG22 HD11 ' A' ' 29' ' ' LEU . 38.8 pt -134.22 160.8 41.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.332 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 56.0 mtmt -116.0 168.16 10.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.09 0.471 . . . . 0.0 111.32 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.417 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 47.3 pttt -67.36 -11.43 57.64 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -141.11 27.24 1.97 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.156 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.422 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 84.8 tt0 -102.44 135.64 43.69 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.791 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.455 ' C ' HD22 ' A' ' 29' ' ' LEU . 63.6 mtt85 -86.66 119.96 27.46 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.02 0.438 . . . . 0.0 110.852 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.58 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.3 mm? -111.05 143.1 42.29 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.456 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.476 ' C ' HG23 ' A' ' 41' ' ' VAL . 4.0 m-90 -104.32 105.28 15.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.325 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.481 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 25.3 mt -80.64 148.79 30.09 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.929 0.395 . . . . 0.0 111.091 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.3 mp -110.19 -26.17 9.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.213 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -158.59 115.44 2.79 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 120.767 0.318 . . . . 0.0 111.042 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.425 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 31.9 p-10 -112.24 16.76 19.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.828 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.0 p -78.95 -36.68 41.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.988 0.423 . . . . 0.0 110.976 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -85.29 161.58 19.46 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.771 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 20.7 p -55.74 -41.03 73.34 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.407 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 49.8 m95 -92.48 133.45 35.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.485 -1.234 . . . . 0.0 109.165 178.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.44 ' CE3' HD13 ' A' ' 31' ' ' LEU . 38.4 m0 -106.89 132.59 52.67 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -86.97 132.94 33.64 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.58 HG21 ' HB3' ' A' ' 29' ' ' LEU . 4.2 p -149.0 155.32 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -177.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.412 ' CB ' HG22 ' A' ' 48' ' ' THR . 80.2 ttt180 -124.07 147.15 48.1 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.942 0.401 . . . . 0.0 111.691 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.824 ' HB2' HD21 ' A' ' 21' ' ' LEU . 39.7 t30 -111.19 164.69 12.61 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.699 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.78 -17.99 61.97 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.677 177.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.501 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -81.18 5.89 15.56 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.011 179.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 68.31 25.18 7.15 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.773 0.32 . . . . 0.0 111.713 -179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.548 ' O ' HD13 ' A' ' 21' ' ' LEU . 82.1 mtt85 -111.56 128.72 56.12 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 178.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.412 HG22 ' CB ' ' A' ' 42' ' ' ARG . 77.8 p -117.42 153.87 32.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.967 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.475 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -171.87 168.83 41.96 Favored Glycine 0 CA--C 1.524 0.635 0 C-N-CA 120.512 -0.852 . . . . 0.0 113.567 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -103.33 105.91 16.3 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.593 HG11 ' O ' ' A' ' 21' ' ' LEU . 5.1 m -127.19 112.85 21.56 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 111.604 0.224 . . . . 0.0 111.604 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.407 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 11.8 Cg_exo -71.16 36.23 0.29 Allowed 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 122.6 2.2 . . . . 0.0 112.683 178.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.475 ' OG ' HD11 ' A' ' 23' ' ' ILE . 41.8 t -67.0 93.45 0.28 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.022 0.439 . . . . 0.0 111.897 -178.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -71.07 -9.71 58.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.365 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.572 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.7 m-85 -64.38 -13.34 50.27 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.993 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.591 HG23 ' C ' ' A' ' 8' ' ' ILE . 5.8 p -116.16 143.72 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.12 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -148.56 160.29 43.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.896 0.379 . . . . 0.0 111.357 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.416 ' CA ' HG12 ' A' ' 7' ' ' VAL . 64.4 ttt-85 -72.27 134.81 45.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.928 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 99.4 mttt . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.522 179.134 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptp . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 120.84 0.353 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.0 t -94.2 -1.07 54.69 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.835 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -98.83 138.52 35.84 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.826 0.346 . . . . 0.0 111.069 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -101.09 139.64 36.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.243 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.528 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.0 t -109.52 127.68 66.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.358 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 8.1 mt -103.91 120.39 54.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.388 -179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.743 HG12 ' CA ' ' A' ' 58' ' ' ARG . 21.0 m -132.41 160.03 42.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.571 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.678 ' C ' HG23 ' A' ' 56' ' ' VAL . 51.7 mt -117.82 122.75 70.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.08 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.512 ' N ' HG23 ' A' ' 56' ' ' VAL . . . -74.84 122.2 23.01 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.139 0.495 . . . . 0.0 111.71 -178.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -91.39 -2.81 57.21 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.38 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.585 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 8.4 m-90 -145.66 143.51 29.86 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 120.779 0.323 . . . . 0.0 110.949 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.9 p-10 -72.4 122.71 21.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.198 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.448 ' HE1' HG13 ' A' ' 51' ' ' VAL . 62.4 t80 -128.39 140.47 51.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.17 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.3 m -100.82 136.18 41.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.61 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.792 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -56.97 134.67 55.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.351 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -65.73 -34.33 77.95 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.086 0.469 . . . . 0.0 110.272 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -128.8 168.38 15.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.233 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -68.01 -34.34 76.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.978 0.418 . . . . 0.0 111.164 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -62.89 -26.26 68.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.085 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.792 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -80.64 -178.68 6.86 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.493 HD12 ' C ' ' A' ' 20' ' ' GLU . 7.3 mp -124.62 145.52 49.59 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.587 -178.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -83.64 149.81 26.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.028 178.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.435 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 43.8 pt -130.79 166.12 29.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.159 179.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -120.3 166.76 13.07 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.287 0.565 . . . . 0.0 110.962 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 21.2 pttp -66.61 -12.9 60.1 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.739 -179.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -135.4 22.07 3.42 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.208 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -101.08 143.42 31.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.875 0.369 . . . . 0.0 110.592 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.559 ' C ' HD22 ' A' ' 29' ' ' LEU . 26.3 ptt85 -102.86 128.35 49.67 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.935 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.559 HD22 ' C ' ' A' ' 28' ' ' ARG . 0.7 OUTLIER -115.81 151.76 34.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.189 -178.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 8.7 m-90 -100.51 110.63 22.81 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.046 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.528 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 86.7 mt -75.41 145.65 41.41 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.946 0.403 . . . . 0.0 111.573 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.607 HD13 ' HG2' ' A' ' 40' ' ' ARG . 5.3 mp -111.69 -29.87 7.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.007 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.2 t0 -161.02 119.86 2.53 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.863 0.363 . . . . 0.0 110.952 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.44 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.4 p-10 -106.44 1.97 26.0 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.3 m -64.9 -39.17 93.11 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -81.32 158.79 24.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.195 0.521 . . . . 0.0 112.192 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 94.2 m -58.64 -36.22 73.77 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.024 178.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.498 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 21.1 m95 -99.37 125.41 45.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.44 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 41.7 m0 -95.11 138.98 32.09 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -177.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.607 ' HG2' HD13 ' A' ' 32' ' ' LEU . 34.9 ttm180 -92.8 136.27 33.39 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 177.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.579 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.8 OUTLIER -141.51 159.68 21.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.834 -178.325 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 76.9 ttt180 -121.6 145.06 48.36 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.242 -179.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.445 ' HB2' HD23 ' A' ' 21' ' ' LEU . 52.0 t30 -111.0 162.76 14.53 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.934 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.12 -23.15 45.06 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.852 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.52 5.46 7.32 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 179.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 19.3 m120 71.33 26.6 3.3 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 120.874 0.369 . . . . 0.0 110.714 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.403 ' C ' HD21 ' A' ' 21' ' ' LEU . 25.9 mmt85 -106.34 145.75 31.28 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.765 178.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.4 p -135.21 148.84 49.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.723 0.297 . . . . 0.0 111.135 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 40' ' ' ARG . . . -171.15 -172.03 36.95 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.851 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -108.89 112.35 24.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.712 0.291 . . . . 0.0 111.419 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.448 HG13 ' HE1' ' A' ' 13' ' ' TYR . 21.7 t -127.09 113.3 21.74 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.416 178.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.498 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 59.9 Cg_endo -76.94 31.11 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.414 2.076 . . . . 0.0 112.484 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.662 ' O ' HG12 ' A' ' 56' ' ' VAL . 13.8 p -62.43 87.24 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.772 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -72.86 -8.12 54.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.517 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.585 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 99.6 m-85 -71.79 -1.29 13.54 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.678 HG23 ' C ' ' A' ' 8' ' ' ILE . 6.5 p -111.04 144.78 18.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-O 120.877 0.37 . . . . 0.0 110.922 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -136.03 148.79 48.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.988 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.743 ' CA ' HG12 ' A' ' 7' ' ' VAL . 78.2 ttt-85 -70.43 138.97 51.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.868 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 62.3 tttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.861 179.638 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.9 mtm . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.826 0.345 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.632 HG22 ' H ' ' A' ' 4' ' ' GLU . 42.5 m -77.79 129.42 35.44 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.718 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -91.64 -3.14 56.69 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.798 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.632 ' H ' HG22 ' A' ' 2' ' ' THR . 99.4 mt-10 -94.33 139.67 30.79 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.165 0.507 . . . . 0.0 111.154 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.462 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.7 t -114.41 130.02 69.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.369 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.9 mt -104.5 121.08 55.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.842 0.353 . . . . 0.0 110.939 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.761 HG12 ' HA ' ' A' ' 58' ' ' ARG . 27.2 m -132.34 162.72 39.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.964 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.751 HG23 ' HG2' ' A' ' 28' ' ' ARG . 24.3 mt -116.76 128.46 74.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.642 179.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.482 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.63 146.75 44.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.037 0.446 . . . . 0.0 111.119 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.419 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 30.9 mtpp -110.25 -21.9 12.01 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.328 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.517 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.9 m-90 -137.47 142.08 41.55 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.164 0.507 . . . . 0.0 110.975 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -65.37 127.1 30.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.535 -179.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.467 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 68.0 t80 -128.47 140.24 51.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.707 179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.9 m -101.91 134.12 45.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.737 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.788 ' HB1' ' HG3' ' A' ' 20' ' ' GLU . . . -51.87 128.23 23.4 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.35 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -67.82 -24.26 65.27 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.953 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -146.42 171.47 14.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.919 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -67.19 -35.04 78.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.928 0.394 . . . . 0.0 111.585 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -58.17 -40.43 81.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.058 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.788 ' HG3' ' HB1' ' A' ' 15' ' ' ALA . 5.5 pt-20 -83.41 -179.55 7.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.075 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.653 HD21 ' CB ' ' A' ' 47' ' ' ARG . 8.6 mp -122.22 162.26 21.72 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -89.33 144.43 26.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.92 178.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.597 HG22 HD11 ' A' ' 29' ' ' LEU . 34.6 pt -128.95 163.98 32.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 178.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.438 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 96.4 mttt -111.94 -179.12 3.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.339 0.59 . . . . 0.0 111.442 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 32.9 ttmt -61.8 -51.99 66.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.808 -179.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -105.82 -7.46 18.29 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.438 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 74.9 tt0 -54.03 145.2 17.29 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.036 0.446 . . . . 0.0 111.363 -179.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.751 ' HG2' HG23 ' A' ' 8' ' ' ILE . 99.4 mtt180 -101.95 125.87 48.73 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.531 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.676 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.0 OUTLIER -114.6 146.88 40.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.33 -179.165 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -100.91 111.65 23.9 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.172 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.585 HD23 HG23 ' A' ' 41' ' ' VAL . 83.0 mt -76.32 143.73 40.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.758 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.529 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -111.46 -28.25 8.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.909 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -160.97 120.31 2.61 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.116 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.436 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 94.4 m-20 -109.17 5.2 23.69 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.942 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 t -69.62 -35.98 75.74 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.846 0.355 . . . . 0.0 111.427 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -83.23 157.4 22.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.668 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 90.5 m -56.83 -35.78 69.21 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 16.3 m95 -98.89 131.54 44.9 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 177.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.436 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 43.5 m0 -101.47 134.25 44.85 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.419 0.525 . . . . 0.0 112.419 -177.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.439 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 46.2 ttt85 -88.08 131.81 34.54 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.337 178.393 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.676 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -133.31 163.4 37.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.601 -178.522 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -126.77 140.9 52.03 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.367 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -108.82 162.99 13.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.823 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.73 -22.75 58.45 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.551 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.76 4.45 9.6 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.9 t30 74.31 24.17 1.91 Allowed 'General case' 0 C--N 1.342 0.258 0 C-N-CA 122.505 0.322 . . . . 0.0 110.952 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.653 ' CB ' HD21 ' A' ' 21' ' ' LEU . 95.4 mtt-85 -105.59 142.83 34.65 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.097 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 78.4 p -132.82 147.05 52.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.803 0.335 . . . . 0.0 111.277 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.476 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -170.31 176.83 43.83 Favored Glycine 0 CA--C 1.523 0.567 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.557 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.439 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 96.1 m-85 -103.13 99.39 9.26 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -179.075 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.739 HG22 ' HB2' ' A' ' 20' ' ' GLU . 19.8 t -108.1 111.83 61.78 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.294 179.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.86 32.93 0.33 Allowed 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.132 1.888 . . . . 0.0 112.448 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.45 ' O ' HG12 ' A' ' 56' ' ' VAL . 15.8 p -65.04 91.69 0.1 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.793 0.33 . . . . 0.0 111.344 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -72.6 -7.4 50.03 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.971 178.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.517 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.4 m-85 -66.81 -10.22 45.48 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.861 0.465 . . . . 0.0 112.231 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.622 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.5 p -115.49 143.63 24.92 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.122 0 CA-C-O 121.025 0.441 . . . . 0.0 110.805 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.28 157.24 46.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.528 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.761 ' HA ' HG12 ' A' ' 7' ' ' VAL . 73.8 ttp85 -79.73 132.08 36.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.95 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.3 mtmm . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.316 -0.849 . . . . 0.0 110.891 179.832 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.8 mtt . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.662 0.267 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 71.5 p -89.12 -0.65 57.61 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.882 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -101.07 133.62 45.31 Favored 'General case' 0 CA--C 1.527 0.066 0 CA-C-O 120.904 0.383 . . . . 0.0 111.221 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -98.82 138.67 35.63 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.766 179.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.529 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 63.5 t -111.29 130.39 64.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.676 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.5 mt -104.07 121.0 55.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.286 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.605 HG12 ' HA ' ' A' ' 58' ' ' ARG . 22.2 m -132.55 162.35 39.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.809 0.338 . . . . 0.0 111.685 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.746 HG23 ' HG2' ' A' ' 28' ' ' ARG . 15.7 mt -123.62 120.61 60.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.85 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.506 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.6 129.24 37.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.643 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -95.32 -6.57 40.93 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.367 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.511 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.1 m-90 -147.34 142.25 26.91 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.848 0.356 . . . . 0.0 110.85 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.43 122.25 20.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.42 -179.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.404 ' CE1' ' O ' ' A' ' 14' ' ' THR . 60.2 t80 -127.46 138.37 52.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.511 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.404 ' O ' ' CE1' ' A' ' 13' ' ' TYR . 27.2 m -98.37 139.63 33.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.9 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.757 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -53.45 128.02 27.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.754 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -61.46 -33.0 73.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.204 0.526 . . . . 0.0 110.426 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -135.76 162.0 33.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.699 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -59.17 -35.69 73.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.918 0.39 . . . . 0.0 111.659 -179.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -66.06 -20.29 66.13 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.6 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.757 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.3 mm-40 -81.74 -179.83 7.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.948 0.404 . . . . 0.0 110.259 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.744 HD21 ' HB2' ' A' ' 43' ' ' ASN . 9.2 tp -120.21 145.59 46.85 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.681 -178.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -86.71 146.35 26.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.575 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.479 HG22 ' HG ' ' A' ' 29' ' ' LEU . 29.5 pt -131.13 164.29 34.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.106 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -121.59 168.9 11.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.233 0.539 . . . . 0.0 111.067 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.485 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 53.9 pttt -67.1 -15.27 63.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.386 -0.824 . . . . 0.0 113.162 -178.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -139.01 23.61 2.59 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.534 -0.466 . . . . 0.0 111.213 179.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -99.85 139.1 36.0 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.113 0.482 . . . . 0.0 110.641 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.746 ' HG2' HG23 ' A' ' 8' ' ' ILE . 60.6 mtt85 -92.65 121.43 34.07 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.76 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.507 HD22 ' C ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -113.92 150.07 34.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.875 0.369 . . . . 0.0 110.683 -179.607 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.7 m-90 -102.71 113.53 27.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.404 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.529 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 61.0 mt -78.78 143.41 36.12 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.053 0.454 . . . . 0.0 111.28 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -107.82 -28.18 9.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.78 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -159.1 117.05 2.83 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.947 0.403 . . . . 0.0 110.889 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.448 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 11.9 p-10 -107.0 1.61 24.53 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.047 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.5 t -67.13 -37.76 84.39 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.88 0.371 . . . . 0.0 111.517 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -81.06 159.51 24.74 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 121.67 0.748 . . . . 0.0 112.779 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 16.9 p -56.96 -39.9 75.47 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.255 178.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -97.15 132.67 42.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.79 -1.095 . . . . 0.0 108.366 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.448 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 36.1 m0 -102.2 136.66 41.64 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -177.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 44.2 ttt180 -93.49 137.78 32.43 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 177.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.51 ' HA ' HD12 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -142.37 162.53 18.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.701 -0.4 . . . . 0.0 111.263 -178.316 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.43 ' HG3' HG22 ' A' ' 48' ' ' THR . 65.7 ttt180 -125.04 143.41 50.93 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.041 0.448 . . . . 0.0 111.891 -178.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.744 ' HB2' HD21 ' A' ' 21' ' ' LEU . 59.9 t30 -110.61 164.64 12.53 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.923 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.61 -22.97 64.34 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.804 178.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.97 5.33 11.91 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.043 179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 67.82 26.56 7.63 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.95 0.405 . . . . 0.0 111.271 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.537 ' O ' HD13 ' A' ' 21' ' ' LEU . 27.1 ttm180 -110.4 127.65 55.19 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.43 HG22 ' HG3' ' A' ' 42' ' ' ARG . 37.3 p -122.72 152.62 40.4 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.832 0.349 . . . . 0.0 110.997 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.421 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -168.22 173.1 43.01 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.524 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -100.92 107.16 18.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.916 0.389 . . . . 0.0 111.17 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.724 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.3 t -119.75 113.91 34.39 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.058 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.08 42.81 1.04 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 121.804 1.669 . . . . 0.0 111.82 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.472 ' O ' HG12 ' A' ' 56' ' ' VAL . 2.8 p -70.62 88.45 0.69 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.096 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -66.54 -13.98 61.71 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.124 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.511 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.8 m-85 -61.67 -15.45 40.2 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.506 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.4 p -107.07 141.85 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-O 120.984 0.421 . . . . 0.0 110.451 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -127.44 151.35 48.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.768 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.605 ' HA ' HG12 ' A' ' 7' ' ' VAL . 76.4 mtp180 -69.57 139.9 53.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.836 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.537 ' HZ3' ' HB ' ' A' ' 8' ' ' ILE . 20.1 pttm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.909 179.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.5 mtm . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 120.95 0.405 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.7 t -98.33 123.23 42.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.406 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -98.39 127.82 44.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.636 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -80.01 144.48 33.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.002 0.43 . . . . 0.0 110.953 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.448 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 77.9 t -116.13 133.88 61.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.949 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.5 mt -115.01 114.42 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.409 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.642 HG12 ' HA ' ' A' ' 58' ' ' ARG . 32.2 m -130.68 163.72 35.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.776 0.322 . . . . 0.0 111.55 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.598 ' C ' HG23 ' A' ' 56' ' ' VAL . 13.7 mt -121.94 121.93 65.42 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.413 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.601 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -78.45 120.26 22.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.677 -179.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -91.11 -7.71 50.88 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.562 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.642 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.8 m-90 -143.57 143.18 31.4 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.956 0.408 . . . . 0.0 110.705 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -72.08 120.47 17.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.129 0.49 . . . . 0.0 111.751 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.465 ' HB3' HD11 ' A' ' 23' ' ' ILE . 60.1 t80 -128.26 134.7 49.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.766 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.8 m -100.83 138.69 37.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.488 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.649 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -56.54 132.51 51.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.491 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.437 ' HB2' ' OE2' ' A' ' 20' ' ' GLU . 99.0 mm-40 -69.96 -16.06 63.14 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.998 179.191 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -141.64 172.89 12.06 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -74.38 -34.3 63.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.264 0.554 . . . . 0.0 110.533 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.77 -19.13 64.74 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.135 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.649 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -86.4 -179.85 6.74 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.995 -0.282 . . . . 0.0 110.635 -179.264 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.99 HD21 ' HB2' ' A' ' 43' ' ' ASN . 28.6 tp -122.1 130.72 53.5 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -177.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -71.23 142.24 50.58 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.194 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.465 HD11 ' HB3' ' A' ' 13' ' ' TYR . 38.1 pt -129.03 164.48 31.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.374 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 66.5 mttm -120.98 167.02 13.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.227 0.537 . . . . 0.0 111.366 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 56.2 pttt -66.84 -12.91 60.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.334 -0.848 . . . . 0.0 113.101 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -141.52 28.35 1.82 Allowed 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 72.5 tt0 -105.09 140.57 38.07 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.085 0.469 . . . . 0.0 110.928 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.488 ' C ' HD22 ' A' ' 29' ' ' LEU . 66.4 mtp180 -92.46 119.12 31.66 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.184 -179.564 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.551 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.5 mm? -112.23 150.91 30.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.511 -179.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -107.2 106.49 16.99 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.612 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.511 ' HA ' HG23 ' A' ' 41' ' ' VAL . 39.3 mt -76.06 149.67 37.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.44 0.638 . . . . 0.0 111.334 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -112.19 -30.43 7.21 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.643 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.1 m-20 -157.04 113.91 3.05 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.529 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.454 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -106.49 2.47 26.29 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 74.2 m -65.18 -37.9 88.8 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 120.843 0.354 . . . . 0.0 111.308 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -82.58 158.21 23.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.545 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -34.59 69.6 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.383 0.611 . . . . 0.0 109.383 178.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.475 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 37.4 m95 -96.21 129.84 43.42 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 114.985 -1.007 . . . . 0.0 108.703 177.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.454 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 38.6 m0 -104.11 132.53 50.27 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -177.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -90.03 131.06 36.11 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 177.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.647 HG13 HD23 ' A' ' 21' ' ' LEU . 0.7 OUTLIER -142.5 157.63 19.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.41 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.479 ' CB ' HG22 ' A' ' 48' ' ' THR . 36.5 ttp180 -123.59 141.85 51.61 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.707 -179.028 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.99 ' HB2' HD21 ' A' ' 21' ' ' LEU . 51.7 t30 -113.15 162.45 15.95 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.016 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.03 -18.91 15.85 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.882 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.71 5.27 11.56 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 67.39 26.05 8.49 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-O 120.852 0.358 . . . . 0.0 111.065 -179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -115.25 125.81 53.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.812 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.479 HG22 ' CB ' ' A' ' 42' ' ' ARG . 60.3 p -116.81 151.44 36.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.878 0.371 . . . . 0.0 111.032 -179.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.538 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.25 168.38 38.63 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.197 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -102.37 102.65 13.01 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.432 HG13 ' HB3' ' A' ' 20' ' ' GLU . 6.3 m -120.08 122.99 28.59 Favored Pre-proline 0 C--N 1.325 -0.479 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.729 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.475 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 84.2 Cg_endo -80.62 29.28 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.25 1.967 . . . . 0.0 112.333 178.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.407 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -58.66 91.89 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.3 -179.382 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -68.96 -12.7 61.9 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.059 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.642 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 99.1 m-85 -63.8 -13.79 47.31 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.424 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.601 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.2 p -113.39 142.4 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-O 121.023 0.44 . . . . 0.0 110.579 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -140.61 157.87 44.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.522 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.642 ' HA ' HG12 ' A' ' 7' ' ' VAL . 36.5 ttm180 -69.67 137.74 52.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.9 0.381 . . . . 0.0 110.804 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.4 tttt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.802 -179.78 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.5 mtp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.822 0.344 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 80.5 p -73.49 154.79 39.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.06 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -92.19 136.48 33.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.001 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -98.44 139.95 33.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.034 0.445 . . . . 0.0 111.112 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.7 t -114.88 128.28 72.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.891 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.5 mt -104.28 116.26 47.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.911 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 58' ' ' ARG . 26.4 m -130.83 163.07 37.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.983 0.42 . . . . 0.0 111.653 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.527 HD12 ' HD2' ' A' ' 59' ' ' LYS . 13.9 mt -123.65 133.49 69.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.019 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.433 ' HB1' HD12 ' A' ' 23' ' ' ILE . . . -80.33 137.01 36.51 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.675 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -102.74 7.45 39.66 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.696 ' CE3' ' HB2' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -163.06 151.18 13.78 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.805 0.336 . . . . 0.0 110.506 178.726 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.421 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 43.3 t0 -79.11 113.68 17.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.031 0.444 . . . . 0.0 111.91 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.492 ' HB2' ' CE2' ' A' ' 11' ' ' TRP . 56.4 t80 -127.57 145.79 50.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.16 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.9 t -105.75 135.22 47.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.373 178.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.722 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -52.75 139.24 27.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.476 . . . . 0.0 112.025 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -64.52 -31.34 72.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.071 0.463 . . . . 0.0 109.817 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -136.73 165.29 26.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.614 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -62.91 -27.89 69.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.861 0.362 . . . . 0.0 110.97 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -68.05 -26.21 65.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.14 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.722 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -89.08 176.92 6.79 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.595 ' O ' HG11 ' A' ' 51' ' ' VAL . 6.7 mp -128.01 141.55 51.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.999 0.428 . . . . 0.0 111.275 -179.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.0 p-10 -79.17 157.81 27.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.36 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.649 HG22 ' HG ' ' A' ' 29' ' ' LEU . 44.5 pt -127.93 155.48 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.028 179.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 95.4 mttt -111.25 172.45 6.87 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.845 0.355 . . . . 0.0 111.049 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.498 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 19.5 pttp -68.01 -12.96 61.77 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -178.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -151.97 29.38 0.58 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.477 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 59.2 tt0 -98.77 142.06 30.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.84 0.352 . . . . 0.0 110.961 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.507 ' C ' HD22 ' A' ' 29' ' ' LEU . 35.5 mtm-85 -92.3 121.59 33.95 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.404 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.649 ' HG ' HG22 ' A' ' 23' ' ' ILE . 0.6 OUTLIER -116.09 149.02 39.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.713 179.553 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.8 m-90 -100.42 107.25 18.95 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.964 0.411 . . . . 0.0 110.743 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.576 HD21 ' HB3' ' A' ' 39' ' ' TRP . 0.1 OUTLIER -86.48 152.02 23.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.309 0.576 . . . . 0.0 112.444 -178.651 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.42 HD22 ' NH1' ' A' ' 40' ' ' ARG . 3.2 mp -114.0 -22.38 10.1 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.395 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -163.05 120.61 1.94 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.822 0.344 . . . . 0.0 110.815 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.506 ' HB3' HD22 ' A' ' 31' ' ' LEU . 30.1 p-10 -117.26 19.38 14.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.1 t -81.57 -34.99 30.71 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.741 0.305 . . . . 0.0 111.368 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.4 mmtm -86.87 160.9 18.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.925 0.393 . . . . 0.0 111.624 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 28.8 m -57.09 -33.98 67.85 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 121.352 0.596 . . . . 0.0 109.654 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.434 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 17.5 m95 -99.31 126.38 45.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 177.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.576 ' HB3' HD21 ' A' ' 31' ' ' LEU . 37.7 m0 -99.1 132.06 44.68 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.42 ' NH1' HD22 ' A' ' 32' ' ' LEU . 35.1 ttt180 -88.02 125.78 34.73 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.569 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.8 p -136.9 162.12 34.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -177.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.472 ' HG3' HG22 ' A' ' 48' ' ' THR . 79.1 ttt180 -130.38 148.44 52.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.15 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -117.0 171.52 7.86 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.135 0.493 . . . . 0.0 112.034 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.2 -18.21 60.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.869 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.81 6.47 10.91 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 67.63 24.1 8.59 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 120.899 0.381 . . . . 0.0 111.14 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.578 ' O ' HD21 ' A' ' 21' ' ' LEU . 99.4 mtt180 -111.03 128.37 55.84 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.861 178.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.472 HG22 ' HG3' ' A' ' 42' ' ' ARG . 16.5 p -113.66 159.11 20.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.513 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.506 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -175.1 176.75 47.21 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.18 -1.009 . . . . 0.0 113.347 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 65.2 m-85 -115.99 110.51 19.04 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.595 HG11 ' O ' ' A' ' 21' ' ' LEU . 0.3 OUTLIER -122.99 127.68 25.61 Favored Pre-proline 0 CA--C 1.532 0.251 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.618 178.308 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.434 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 76.7 Cg_endo -76.43 58.6 5.84 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.114 1.876 . . . . 0.0 111.765 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.3 p -66.97 94.36 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -60.42 -60.55 3.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.05 0.452 . . . . 0.0 109.951 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.696 ' HB2' ' CE3' ' A' ' 11' ' ' TRP . 19.5 m-85 -84.35 97.39 9.44 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 122.582 1.182 . . . . 0.0 113.431 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.1 p -155.45 140.84 10.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 114.108 -1.405 . . . . 0.0 108.698 177.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -121.43 134.7 55.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.832 0.349 . . . . 0.0 111.679 -178.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.435 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 67.9 ttp85 -78.56 133.42 37.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.867 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.527 ' HD2' HD12 ' A' ' 8' ' ' ILE . 22.1 mttm . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.174 -0.917 . . . . 0.0 111.007 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mtm . . . . . 0 N--CA 1.488 1.449 0 CA-C-O 120.832 0.348 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 81.1 p -89.8 0.4 57.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.729 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -66.53 -33.32 75.43 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-O 121.079 0.466 . . . . 0.0 110.989 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -76.44 137.48 39.74 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.122 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 30' ' ' TRP . 57.3 t -114.6 130.05 69.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.482 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 8.2 mt -106.14 116.71 50.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.766 0.317 . . . . 0.0 111.297 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.528 HG12 ' CB ' ' A' ' 58' ' ' ARG . 34.8 m -131.33 161.21 41.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.215 179.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.583 HG23 ' HG2' ' A' ' 28' ' ' ARG . 18.9 mt -122.41 126.3 73.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.78 179.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.624 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.77 144.94 41.13 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.941 -179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -110.14 -25.68 10.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.335 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.491 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 8.3 m-90 -133.36 137.63 45.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -61.98 122.05 14.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.621 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.446 ' HB3' HD11 ' A' ' 23' ' ' ILE . 53.2 t80 -127.09 137.35 53.0 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.648 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 88.7 m -105.94 137.67 43.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.553 179.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.735 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -53.4 142.58 21.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.218 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -88.24 -8.31 55.46 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.272 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -149.12 167.54 25.65 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.646 0.26 . . . . 0.0 110.508 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -68.14 -29.27 68.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.335 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -77.22 -11.33 59.81 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.863 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.735 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -89.69 179.26 6.06 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.86 HD21 ' HB2' ' A' ' 43' ' ' ASN . 44.0 tp -121.7 134.63 54.96 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.026 0.441 . . . . 0.0 111.71 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -77.11 144.47 38.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.853 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.446 HD11 ' HB3' ' A' ' 13' ' ' TYR . 23.1 pt -131.83 164.66 34.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.109 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -113.13 -177.03 3.03 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.952 0.406 . . . . 0.0 111.284 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.7 ttmt -64.91 -51.49 61.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.859 -0.61 . . . . 0.0 112.586 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.7 m120 -109.83 -5.6 15.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -57.05 144.63 33.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.813 0.34 . . . . 0.0 111.25 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.583 ' HG2' HG23 ' A' ' 8' ' ' ILE . 81.8 mtm180 -97.63 124.35 41.88 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.63 179.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.655 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.8 mm? -111.59 147.13 36.12 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.895 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.41 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 6.2 m-90 -104.33 104.24 14.1 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.144 -179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.915 HD11 ' HB3' ' A' ' 39' ' ' TRP . 0.5 OUTLIER -72.23 147.63 46.3 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.3 0.572 . . . . 0.0 112.259 -179.057 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.2 mp -109.82 -26.68 9.68 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.976 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -160.99 118.16 2.33 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 120.808 0.337 . . . . 0.0 111.257 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.44 ' OD2' ' HG ' ' A' ' 31' ' ' LEU . 97.0 m-20 -105.61 3.62 29.4 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.159 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 57.7 m -68.57 -35.36 77.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.708 0.289 . . . . 0.0 111.721 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -85.68 156.48 20.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.257 0.551 . . . . 0.0 112.264 -179.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 58.6 m -57.72 -31.8 66.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.188 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.485 ' CD2' ' HG3' ' A' ' 52' ' ' PRO . 7.4 m0 -100.26 132.99 45.32 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.915 ' HB3' HD11 ' A' ' 31' ' ' LEU . 23.5 m0 -100.69 128.97 46.55 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -176.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.805 ' O ' HD13 ' A' ' 31' ' ' LEU . 72.6 ttt180 -87.94 122.82 32.01 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.812 HG13 HD23 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -138.45 151.09 24.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 120.475 -0.49 . . . . 0.0 112.219 -177.835 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.451 ' CB ' ' HB ' ' A' ' 48' ' ' THR . 24.4 ttp-105 -121.92 146.72 46.85 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.3 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.86 ' HB2' HD21 ' A' ' 21' ' ' LEU . 57.6 t30 -116.05 164.6 14.22 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.363 -179.275 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.38 -18.26 16.72 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.867 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.89 4.78 11.11 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 44.3 t30 72.64 21.59 3.48 Favored 'General case' 0 C--N 1.339 0.116 0 CA-C-O 120.859 0.361 . . . . 0.0 111.302 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.457 ' O ' HD13 ' A' ' 21' ' ' LEU . 95.6 mtt180 -114.8 130.49 56.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 0.0 109.905 179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.451 ' HB ' ' CB ' ' A' ' 42' ' ' ARG . 12.2 t -141.34 143.17 33.87 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.778 -179.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.455 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.47 178.64 39.64 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.371 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.4 m-85 -93.38 113.17 25.28 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.632 0.253 . . . . 0.0 111.512 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.516 HG13 ' HB3' ' A' ' 20' ' ' GLU . 4.6 m -127.46 120.94 22.21 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.846 -0.161 . . . . 0.0 111.263 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.485 ' HG3' ' CD2' ' A' ' 38' ' ' TRP . 6.3 Cg_exo -72.33 30.92 0.27 Allowed 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.421 2.081 . . . . 0.0 112.091 177.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.456 ' O ' HG12 ' A' ' 56' ' ' VAL . 8.4 t -66.0 85.51 0.09 Allowed 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 120.897 0.379 . . . . 0.0 111.135 -179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 p30 -69.09 -9.97 55.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.422 178.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.491 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 80.9 m-85 -65.2 -10.63 33.03 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.624 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.6 p -115.03 141.48 31.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.909 0.385 . . . . 0.0 110.735 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -137.73 150.4 47.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.725 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.528 ' CB ' HG12 ' A' ' 7' ' ' VAL . 67.7 ttt180 -69.53 140.5 53.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.802 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 93.2 mttt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.243 -0.884 . . . . 0.0 111.051 179.968 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.3 mmm . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 120.72 0.295 . . . . 0.0 111.362 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m 57.79 22.23 8.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.227 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -91.33 -9.53 44.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.938 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 85.4 tt0 -69.81 138.95 53.09 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.139 0.495 . . . . 0.0 110.562 179.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.424 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 59.3 t -110.9 121.83 64.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.008 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 5.1 mt -114.06 118.38 58.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.117 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.735 HG12 ' HA ' ' A' ' 58' ' ' ARG . 32.9 m -131.39 162.53 39.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 121.048 0.452 . . . . 0.0 111.623 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.642 HG23 ' HG2' ' A' ' 28' ' ' ARG . 10.5 mt -120.02 123.6 71.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.503 179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.657 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.5 126.5 31.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.202 -179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -96.47 -10.35 27.65 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.336 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.63 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 7.6 m-90 -145.12 143.14 30.22 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.792 0.329 . . . . 0.0 110.577 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -67.8 125.51 26.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.096 0.474 . . . . 0.0 111.62 -178.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.467 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 58.2 t80 -127.8 138.12 52.62 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.844 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.7 t -102.74 140.28 37.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.913 0.387 . . . . 0.0 110.714 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.631 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -61.45 136.24 57.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.474 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -84.39 -3.58 58.39 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.085 179.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.472 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 92.8 mt-30 -145.47 171.65 14.33 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.586 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -76.44 -29.84 57.13 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.935 0.398 . . . . 0.0 111.283 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -75.99 -12.65 60.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.937 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.631 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -88.74 178.02 6.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.933 0.397 . . . . 0.0 110.726 -179.697 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.615 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.5 mp -124.88 139.52 53.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.77 -178.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -78.6 146.41 34.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.354 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.467 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 45.8 pt -129.84 161.87 38.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.473 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -114.72 166.32 11.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.768 0.318 . . . . 0.0 111.025 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.463 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 21.0 pttp -63.75 -11.32 25.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -138.45 25.95 2.62 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.289 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.439 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 83.9 tt0 -99.57 138.01 37.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.854 0.359 . . . . 0.0 110.903 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.642 ' HG2' HG23 ' A' ' 8' ' ' ILE . 75.8 mtp180 -94.1 120.67 34.67 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.124 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.601 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -115.21 150.06 36.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.04 -179.351 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 6.0 m-90 -103.43 107.15 17.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.172 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.459 ' HA ' HG23 ' A' ' 41' ' ' VAL . 89.3 mt -76.69 149.15 36.44 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.051 0.453 . . . . 0.0 111.561 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.0 mp -113.97 -28.63 7.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.036 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -160.99 118.88 2.4 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.552 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.444 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 31.3 p-10 -110.87 2.8 18.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.128 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.0 m -65.06 -36.82 85.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.828 0.347 . . . . 0.0 111.342 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -83.63 158.75 21.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.083 0.468 . . . . 0.0 111.809 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.7 m -57.44 -34.78 69.32 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.564 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 61.3 m95 -97.64 131.61 44.06 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 177.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.479 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 40.5 m0 -103.94 133.79 48.31 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -177.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.422 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 37.4 ttt180 -88.58 130.1 35.33 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.601 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.7 OUTLIER -141.04 155.52 21.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 120.915 0.388 . . . . 0.0 111.589 -178.702 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.458 ' HB2' HG22 ' A' ' 48' ' ' THR . 40.3 ttp180 -120.42 145.58 47.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.605 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.4 t30 -113.04 162.56 15.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.703 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.16 -21.33 46.7 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.879 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.34 5.23 10.96 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.857 179.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.0 t30 72.81 24.68 2.63 Favored 'General case' 0 N--CA 1.46 0.071 0 CA-C-O 120.829 0.347 . . . . 0.0 110.895 -179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.491 ' O ' HD21 ' A' ' 21' ' ' LEU . 82.5 mtm180 -108.92 136.89 47.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.434 179.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.458 HG22 ' HB2' ' A' ' 42' ' ' ARG . 74.8 p -124.81 152.7 43.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.729 0.299 . . . . 0.0 110.905 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -174.23 179.87 45.3 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.56 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.479 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 95.3 m-85 -110.11 113.54 26.32 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.808 0.304 . . . . 0.0 111.618 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.615 HG11 ' O ' ' A' ' 21' ' ' LEU . 29.4 m -131.21 112.02 15.59 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.587 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.564 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 74.0 Cg_endo -74.73 45.24 1.25 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.18 1.92 . . . . 0.0 111.855 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.717 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.4 p -69.61 73.63 0.38 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.038 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -53.57 -19.18 3.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.935 0.398 . . . . 0.0 110.93 178.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.63 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 77.5 m-85 -61.11 -12.83 13.66 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.221 179.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.717 HG12 ' O ' ' A' ' 53' ' ' SER . 11.9 p -110.36 146.15 15.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-O 120.808 0.337 . . . . 0.0 110.943 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.419 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 85.5 tt0 -142.21 164.17 30.88 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.544 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.735 ' HA ' HG12 ' A' ' 7' ' ' VAL . 18.8 mtp180 -68.69 139.28 55.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.528 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.6 tttp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.343 -0.836 . . . . 0.0 110.864 179.938 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.3 mtp . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 120.777 0.322 . . . . 0.0 110.942 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.0 t -99.58 119.96 38.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.22 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -96.68 138.14 34.7 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.86 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -98.99 138.68 35.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.159 0.504 . . . . 0.0 111.378 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.456 ' HB ' ' HB3' ' A' ' 31' ' ' LEU . 64.1 t -119.84 131.91 71.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.382 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.3 mm -100.41 110.97 28.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.807 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.754 HG12 ' HA ' ' A' ' 58' ' ' ARG . 34.6 m -128.49 155.91 40.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.767 0.318 . . . . 0.0 111.348 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.57 HD12 ' HG2' ' A' ' 28' ' ' ARG . 30.6 mm -121.29 126.98 75.68 Favored 'Isoleucine or valine' 0 C--O 1.231 0.13 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.874 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.564 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -73.96 143.14 45.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.496 -179.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.429 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 60.3 mttp -112.42 -24.34 9.8 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.753 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.6 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.3 m-90 -137.1 136.7 38.54 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.045 0.45 . . . . 0.0 110.552 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -59.74 120.8 10.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.394 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.516 ' HB3' HD11 ' A' ' 23' ' ' ILE . 49.3 t80 -127.22 138.39 53.1 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.144 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 86.6 m -107.06 139.64 41.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.657 179.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.574 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.22 135.54 56.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.713 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -87.75 0.32 55.9 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.542 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.467 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 95.8 mt-30 -147.11 167.23 24.63 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -75.05 -20.28 59.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.577 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -88.47 -8.19 55.32 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.574 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -88.54 177.53 6.76 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.658 -179.757 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.947 HD23 HG13 ' A' ' 41' ' ' VAL . 38.6 tp -119.44 128.66 54.23 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -70.4 141.69 52.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.9 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.516 HD11 ' HB3' ' A' ' 13' ' ' TYR . 35.9 pt -130.65 162.59 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.253 179.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 88.3 mttt -110.95 -177.27 3.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.901 0.381 . . . . 0.0 110.767 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HG3' ' HA ' ' A' ' 11' ' ' TRP . 27.6 ttpp -65.3 -48.76 72.01 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.626 -178.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.7 m120 -114.61 -0.25 13.71 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.443 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 66.3 tt0 -57.62 144.11 38.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.105 0.479 . . . . 0.0 111.175 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.57 ' HG2' HD12 ' A' ' 8' ' ' ILE . 89.1 mtt180 -91.49 121.67 33.39 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.467 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.726 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.7 mm? -115.28 140.65 48.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.344 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 16.2 m-90 -100.89 105.26 16.51 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.793 178.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.672 HD11 ' HB3' ' A' ' 39' ' ' TRP . 5.6 tp -84.1 151.34 24.99 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.6 mp -107.92 -19.32 13.56 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.757 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -168.82 125.12 0.95 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.787 0.327 . . . . 0.0 111.326 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.418 ' HB3' HD23 ' A' ' 31' ' ' LEU . 34.1 p-10 -115.58 2.18 13.73 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.682 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.2 m -64.13 -38.33 90.65 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.791 0.329 . . . . 0.0 111.623 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -82.9 159.01 22.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.002 0.429 . . . . 0.0 111.746 -179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 98.8 m -58.94 -35.58 73.36 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.476 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 22.6 m95 -94.59 127.67 40.69 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.672 ' HB3' HD11 ' A' ' 31' ' ' LEU . 41.5 m0 -102.06 134.45 45.27 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -177.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.454 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 53.6 ttt180 -92.38 125.81 37.19 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.931 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.947 HG13 HD23 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -139.2 161.79 28.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -178.514 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.637 ' CB ' HG22 ' A' ' 48' ' ' THR . 53.7 ttp180 -125.81 147.58 49.38 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.042 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.922 ' HB3' HD21 ' A' ' 21' ' ' LEU . 47.3 p-10 -118.6 172.25 7.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.012 0.434 . . . . 0.0 111.762 -179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.37 -23.43 65.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.541 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.36 4.97 9.57 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 68.98 25.68 5.89 Favored 'General case' 0 N--CA 1.457 -0.093 0 CA-C-O 120.815 0.34 . . . . 0.0 111.012 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 55.3 mtp180 -111.09 132.46 54.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.692 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.637 HG22 ' CB ' ' A' ' 42' ' ' ARG . 80.6 p -123.49 148.28 46.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.923 -179.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.454 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.2 168.69 40.58 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.39 -0.909 . . . . 0.0 113.142 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.454 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 96.9 m-85 -101.14 103.91 14.98 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 -179.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 20' ' ' GLU . 4.7 m -117.4 119.93 33.91 Favored Pre-proline 0 C--N 1.33 -0.26 0 C-N-CA 121.214 -0.194 . . . . 0.0 111.385 178.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.476 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 72.6 Cg_endo -74.84 41.63 0.75 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.356 2.038 . . . . 0.0 111.6 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.471 ' O ' HG12 ' A' ' 56' ' ' VAL . 80.2 p -71.07 89.93 0.83 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.586 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -66.44 -13.23 60.48 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.589 -0.445 . . . . 0.0 110.166 178.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.6 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 97.5 m-85 -64.11 -12.96 44.29 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.564 HG23 ' HA ' ' A' ' 9' ' ' ALA . 9.4 p -114.6 140.9 33.18 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 121.129 0.49 . . . . 0.0 110.848 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -133.78 163.25 29.89 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.418 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.754 ' HA ' HG12 ' A' ' 7' ' ' VAL . 71.6 ttt-85 -80.21 135.74 36.33 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.47 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.684 179.786 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.4 mtp . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.876 0.37 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.2 p -78.6 148.44 33.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.979 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -91.7 -4.5 55.03 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.687 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -98.76 139.14 34.9 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 121.001 0.429 . . . . 0.0 111.308 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.463 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.7 t -117.25 129.93 72.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.402 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -98.67 112.32 30.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.352 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.762 HG12 ' CA ' ' A' ' 58' ' ' ARG . 35.4 m -131.58 162.28 39.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.045 0.45 . . . . 0.0 111.835 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.59 ' C ' HG23 ' A' ' 56' ' ' VAL . 33.5 mt -120.18 124.58 72.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.851 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.613 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.61 120.43 20.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.061 0.458 . . . . 0.0 111.481 -179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -92.96 -9.49 39.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.421 -0.808 . . . . 0.0 111.842 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.645 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 5.3 m-90 -141.86 142.24 33.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.87 0.366 . . . . 0.0 110.85 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -72.43 123.15 22.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.462 -179.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.445 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 57.8 t80 -127.53 137.77 52.72 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.53 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.01 135.13 41.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.801 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.941 ' HB1' ' HG3' ' A' ' 20' ' ' GLU . . . -61.91 136.84 58.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.032 0.444 . . . . 0.0 111.795 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -86.53 0.14 54.91 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.313 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.474 ' HB2' ' HG2' ' A' ' 20' ' ' GLU . 96.7 mt-30 -153.69 162.0 41.64 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.914 0.387 . . . . 0.0 110.992 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -64.75 -40.21 94.93 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.242 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -61.01 -31.3 70.92 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.918 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.941 ' HG3' ' HB1' ' A' ' 15' ' ' ALA . 6.1 pt-20 -86.47 175.5 8.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.12 -179.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.714 ' O ' HG11 ' A' ' 51' ' ' VAL . 10.6 mp -128.88 158.88 37.52 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -176.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 81.9 m-20 -86.97 149.67 24.61 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.884 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.611 HG22 HD11 ' A' ' 29' ' ' LEU . 47.6 pt -130.68 161.05 41.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.798 178.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 64.6 mttm -115.9 166.54 11.86 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.253 0.549 . . . . 0.0 111.437 -179.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 54.9 pttt -66.37 -11.24 50.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.781 -179.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -140.54 25.35 2.21 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.406 179.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 82.3 tt0 -100.94 140.0 35.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.101 0.477 . . . . 0.0 110.69 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 -91.69 119.57 31.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.824 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.636 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.2 mm? -110.55 143.59 40.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.419 -178.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 29.4 m-90 -98.78 106.01 18.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.985 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.463 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 73.0 mt -75.64 148.77 38.48 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.489 0.662 . . . . 0.0 111.823 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.596 HD23 ' HA ' ' A' ' 41' ' ' VAL . 3.6 mm? -115.27 -35.52 4.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.896 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -160.68 116.96 2.31 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.753 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.444 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.2 p-10 -109.99 3.81 20.79 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.0 t -66.63 -39.24 88.19 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.799 0.333 . . . . 0.0 111.289 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -82.66 159.15 22.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.641 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.0 -34.75 68.46 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 121.417 0.627 . . . . 0.0 109.38 178.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.467 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 63.4 m95 -96.18 130.03 43.34 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 177.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.458 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 39.6 m0 -104.4 127.3 52.06 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -177.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.44 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 66.8 ttt180 -84.9 126.88 33.86 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.636 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -134.69 161.92 39.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.102 0.477 . . . . 0.0 111.87 -178.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.413 ' CB ' HG22 ' A' ' 48' ' ' THR . 41.6 ttm180 -123.66 151.31 43.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.891 -179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.401 ' OD1' HD13 ' A' ' 29' ' ' LEU . 34.0 m-20 -119.68 168.57 10.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.813 0.34 . . . . 0.0 111.246 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.19 67.73 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.382 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.86 4.56 9.52 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.1 t30 72.44 24.06 3.02 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.819 0.343 . . . . 0.0 111.093 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.48 ' CB ' HD21 ' A' ' 21' ' ' LEU . 81.2 mtp180 -106.09 135.5 47.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.413 HG22 ' CB ' ' A' ' 42' ' ' ARG . 77.0 p -124.66 157.58 35.21 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.21 -179.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.687 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -174.02 174.27 46.25 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 120.303 -0.951 . . . . 0.0 113.105 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.458 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 84.7 m-85 -107.2 97.0 6.82 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -178.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.815 HG13 ' HB2' ' A' ' 20' ' ' GLU . 0.8 OUTLIER -115.26 116.91 41.66 Favored Pre-proline 0 N--CA 1.469 0.51 0 CA-C-O 119.622 -0.228 . . . . 0.0 111.361 177.839 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.467 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 73.9 Cg_endo -76.63 44.4 1.4 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.243 1.962 . . . . 0.0 111.464 177.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.52 ' O ' HG12 ' A' ' 56' ' ' VAL . 0.8 OUTLIER -70.26 80.08 0.53 Allowed 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -59.49 -17.28 30.37 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.554 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.645 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 85.7 m-85 -59.82 -12.51 7.57 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.613 HG23 ' HA ' ' A' ' 9' ' ' ALA . 8.6 p -109.6 143.73 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 120.939 0.399 . . . . 0.0 110.96 179.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 55.6 mp0 -143.38 161.22 38.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.583 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.762 ' CA ' HG12 ' A' ' 7' ' ' VAL . 77.8 ttt180 -71.01 140.51 50.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.125 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 88.4 tttt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.753 179.312 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mtm . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.734 0.302 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.3 p -75.64 155.92 35.34 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.948 0.404 . . . . 0.0 111.124 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 85.8 tt0 -97.75 119.34 36.16 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.915 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -102.75 139.23 38.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.407 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 30' ' ' TRP . 93.2 t -115.61 133.25 62.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.184 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.423 HG12 ' CD1' ' A' ' 30' ' ' TRP . 41.5 mt -114.49 115.88 50.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.771 0.32 . . . . 0.0 110.847 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.669 HG12 ' CA ' ' A' ' 58' ' ' ARG . 34.9 m -130.77 159.68 42.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.129 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.625 HD12 ' HG2' ' A' ' 28' ' ' ARG . 16.4 mm -114.93 125.71 72.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.59 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.526 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.05 145.17 42.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.802 0.334 . . . . 0.0 110.862 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -112.75 -23.7 10.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.477 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.58 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 23.8 m-90 -134.21 139.76 46.02 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.975 0.417 . . . . 0.0 110.593 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -66.68 121.22 14.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.282 -178.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.442 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 47.3 t80 -126.25 136.56 52.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.694 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.5 m -103.34 145.56 29.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.841 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.773 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.28 138.92 54.18 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.276 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -84.54 -9.3 58.45 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.975 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.438 ' HB2' ' HG2' ' A' ' 20' ' ' GLU . 74.9 mt-30 -150.75 168.78 23.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -67.08 -34.0 76.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.893 0.378 . . . . 0.0 111.64 -179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -77.66 -6.03 52.45 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.081 -0.509 . . . . 0.0 112.019 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.773 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -87.74 179.04 6.57 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.801 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.959 HD23 HG13 ' A' ' 41' ' ' VAL . 43.7 tp -121.32 119.12 31.27 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -68.32 141.47 55.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.266 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.472 HG22 HD11 ' A' ' 29' ' ' LEU . 14.9 pt -128.14 165.52 27.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.981 179.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 60.2 mttt -114.09 -179.12 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.215 0.531 . . . . 0.0 111.057 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.429 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 36.5 ttpt -64.53 -48.14 76.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.804 -178.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -113.09 2.57 15.74 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.482 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 71.3 tt0 -60.53 148.19 38.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.122 0.487 . . . . 0.0 111.363 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.625 ' HG2' HD12 ' A' ' 8' ' ' ILE . 84.6 mtm180 -94.54 121.32 35.96 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.946 179.46 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.673 ' HB3' HG21 ' A' ' 41' ' ' VAL . 3.6 mm? -114.58 137.79 51.45 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.489 ' C ' HG23 ' A' ' 41' ' ' VAL . 6.3 m0 -101.3 106.01 17.15 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.982 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.446 HD11 ' CZ3' ' A' ' 39' ' ' TRP . 81.3 mt -78.58 154.53 30.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.488 0.661 . . . . 0.0 111.94 -179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.0 mp -117.09 -29.19 6.01 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.808 179.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -158.98 116.65 2.82 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.203 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.489 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 40.2 p-10 -111.14 10.45 21.91 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.5 t -74.2 -35.24 63.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.878 0.371 . . . . 0.0 111.432 -179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmtp -84.4 159.62 20.79 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.794 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 87.9 m -59.27 -32.97 70.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.422 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.451 ' CD1' ' N ' ' A' ' 38' ' ' TRP . 2.8 m95 -96.74 130.95 43.89 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.489 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 32.5 m0 -103.36 135.85 44.22 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -177.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.442 ' HG2' HD13 ' A' ' 32' ' ' LEU . 28.3 ttm180 -96.7 127.86 43.09 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 177.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.959 HG13 HD23 ' A' ' 21' ' ' LEU . 3.8 p -143.55 156.62 16.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.962 -177.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -122.84 143.18 50.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.049 0.452 . . . . 0.0 111.68 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.548 ' CG ' HD21 ' A' ' 21' ' ' LEU . 43.0 m-20 -107.37 161.67 14.6 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.236 179.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.98 -24.28 64.3 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.197 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.67 2.64 11.46 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.357 -0.383 . . . . 0.0 112.032 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.2 t30 73.93 24.38 2.07 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-O 120.678 0.275 . . . . 0.0 111.042 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 83.9 mtt85 -109.39 129.71 55.53 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.308 -0.406 . . . . 0.0 109.956 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 60.1 p -125.15 161.58 26.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.694 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 178.6 169.73 39.71 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.997 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -97.49 108.76 21.54 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.788 0.328 . . . . 0.0 111.689 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.559 HG13 ' HB3' ' A' ' 20' ' ' GLU . 9.6 m -132.3 114.17 14.69 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.64 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -70.77 44.5 0.51 Allowed 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 121.858 1.706 . . . . 0.0 111.761 177.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.525 ' O ' HG12 ' A' ' 56' ' ' VAL . 85.6 p -70.57 76.91 0.58 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-O 121.045 0.45 . . . . 0.0 110.506 -179.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -60.14 -17.97 44.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.638 178.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.58 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 83.0 m-85 -58.86 -15.5 12.87 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.593 HG23 ' C ' ' A' ' 8' ' ' ILE . 4.5 p -112.95 141.12 29.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-O 121.001 0.429 . . . . 0.0 110.676 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -142.96 162.57 35.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.088 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.669 ' CA ' HG12 ' A' ' 7' ' ' VAL . 29.5 ttm180 -70.96 140.59 50.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.772 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.2 -0.905 . . . . 0.0 110.965 -179.907 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.5 mtp . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 120.887 0.375 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.5 t -100.01 135.99 40.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.184 -179.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -95.75 139.49 31.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.874 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -84.7 132.22 34.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.179 0.514 . . . . 0.0 110.995 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.4 t -117.69 128.21 74.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.041 179.883 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.4 mt -104.15 112.97 39.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.438 0.161 . . . . 0.0 111.312 -179.805 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.695 HG12 ' CA ' ' A' ' 58' ' ' ARG . 32.1 m -128.15 162.72 33.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-O 120.794 0.331 . . . . 0.0 111.469 179.315 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.725 HD12 ' HG2' ' A' ' 28' ' ' ARG . 19.3 mm -120.01 120.07 62.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.586 -179.382 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.429 ' N ' HG23 ' A' ' 56' ' ' VAL . . . -76.4 119.65 20.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.745 179.664 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -92.48 -8.37 44.79 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.037 -179.759 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.444 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 7.3 m-90 -142.49 142.4 32.27 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.789 0.328 . . . . 0.0 110.859 -179.594 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -71.56 122.59 20.76 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.046 0.45 . . . . 0.0 110.95 -178.916 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.45 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 58.4 t80 -127.8 137.08 52.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.943 -179.908 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 89.6 m -103.77 139.06 39.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.653 179.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.71 136.73 50.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.575 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -91.18 1.51 57.04 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.441 178.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.514 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 99.3 mt-30 -142.74 166.23 25.23 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.219 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -75.82 -20.9 57.81 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -179.136 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -90.16 -5.51 56.37 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -179.486 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.558 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -87.25 -179.46 6.42 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.051 0.453 . . . . 0.0 111.499 -179.565 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.957 HD21 ' HB2' ' A' ' 43' ' ' ASN . 14.2 tp -124.1 130.67 52.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.526 -178.069 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -72.82 147.54 45.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.467 179.303 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.558 HG22 HD11 ' A' ' 29' ' ' LEU . 37.2 pt -132.2 164.3 35.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.647 179.503 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 59.9 mttt -118.06 167.09 11.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.158 0.504 . . . . 0.0 110.975 179.808 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.444 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 52.6 pttt -66.45 -11.52 52.41 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.931 -179.575 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -141.78 27.73 1.82 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.965 0.412 . . . . 0.0 110.903 179.542 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.511 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 82.0 tt0 -99.69 140.7 33.5 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.208 0.528 . . . . 0.0 111.04 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.725 ' HG2' HD12 ' A' ' 8' ' ' ILE . 76.2 mtm180 -89.16 119.28 29.52 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.712 -179.928 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.733 ' HB3' HG21 ' A' ' 41' ' ' VAL . 3.0 mm? -115.23 139.9 49.55 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.806 -178.165 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.56 ' C ' HG23 ' A' ' 41' ' ' VAL . 5.5 m-90 -103.83 104.42 14.42 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.308 -179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.468 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 33.6 mt -77.56 142.22 39.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.259 0.552 . . . . 0.0 112.05 -178.932 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -105.02 -26.7 12.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.04 -179.899 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -159.03 115.12 2.62 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.803 0.335 . . . . 0.0 110.788 179.739 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.422 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 88.6 m-20 -108.18 4.67 25.06 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.061 -179.746 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.4 p -71.19 -34.32 70.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.967 0.413 . . . . 0.0 111.026 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -83.78 158.14 21.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.716 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 81.3 m -59.32 -33.04 70.64 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.195 178.285 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.447 ' N ' ' CD1' ' A' ' 38' ' ' TRP . 5.5 m95 -98.74 131.7 44.68 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 177.554 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.426 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 35.9 m0 -103.87 130.94 51.5 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -177.404 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.447 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 39.6 ttt85 -88.09 136.4 32.99 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 177.601 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.733 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.4 p -150.36 155.17 7.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.831 -178.879 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.508 ' HG3' HG22 ' A' ' 48' ' ' THR . 48.4 ttp180 -121.4 144.2 48.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.075 -179.709 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.957 ' HB2' HD21 ' A' ' 21' ' ' LEU . 43.8 t-20 -110.41 164.45 12.68 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.062 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.13 -25.4 65.45 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.256 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.26 3.72 8.36 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 179.382 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 73.96 24.36 2.06 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-O 120.749 0.309 . . . . 0.0 110.819 -179.621 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 72.4 mtm180 -108.05 131.56 54.46 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.069 179.52 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.508 HG22 ' HG3' ' A' ' 42' ' ' ARG . 30.6 p -126.34 147.86 49.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.144 -179.472 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.458 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -167.22 167.3 39.77 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.806 179.861 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.447 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.2 m-85 -99.63 106.44 18.39 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 117.082 0.441 . . . . 0.0 112.182 -179.23 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.525 HG13 ' HB3' ' A' ' 20' ' ' GLU . 14.0 m -124.94 114.47 26.54 Favored Pre-proline 0 CA--C 1.534 0.342 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 179.19 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.98 35.4 0.27 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 122.027 1.818 . . . . 0.0 112.211 177.698 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.472 ' O ' HG12 ' A' ' 56' ' ' VAL . 7.5 t -67.93 81.46 0.21 Allowed 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 120.861 0.362 . . . . 0.0 110.426 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -57.11 -19.12 17.9 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.146 0.498 . . . . 0.0 110.626 178.375 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.434 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 91.8 m-85 -54.58 -16.52 2.47 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.728 179.447 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.599 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.6 p -115.69 140.49 37.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 120.958 0.408 . . . . 0.0 111.147 179.826 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -145.54 161.91 38.67 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.891 -179.909 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.695 ' CA ' HG12 ' A' ' 7' ' ' VAL . 67.5 ttp85 -72.48 142.15 48.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.902 179.805 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 94.3 mttt . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.671 179.443 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.6 mmm . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.85 0.357 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.6 t -96.88 131.6 43.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -99.17 119.2 37.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.872 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -98.99 137.38 37.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.1 0.476 . . . . 0.0 111.114 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.506 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 60.4 t -112.28 129.82 67.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.733 179.82 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.473 HG12 ' HD1' ' A' ' 30' ' ' TRP . 24.6 mt -102.6 120.61 52.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.08 -179.98 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.676 HG12 ' HB3' ' A' ' 58' ' ' ARG . 27.2 m -129.62 164.98 30.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.164 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.625 ' C ' HG23 ' A' ' 56' ' ' VAL . 26.2 mt -123.14 123.8 68.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.687 179.545 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.483 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.9 120.51 21.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.346 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.4 mttp -90.04 -7.21 54.45 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.814 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.548 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 5.3 m-90 -144.48 143.25 30.78 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.819 0.343 . . . . 0.0 111.342 -179.604 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -70.45 121.58 18.03 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.548 179.952 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.47 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 63.6 t80 -127.66 140.13 52.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.966 0.412 . . . . 0.0 111.397 -179.476 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 75.0 m -102.21 137.97 39.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.683 179.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.583 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.8 139.23 54.5 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.488 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -89.93 -0.01 57.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.299 179.1 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.496 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 94.2 mt-30 -147.23 163.85 35.05 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 179.225 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -70.59 -24.72 62.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 111.814 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -82.91 -15.51 51.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.271 -0.422 . . . . 0.0 112.115 -179.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.583 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -85.88 177.53 7.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.097 0.475 . . . . 0.0 110.431 179.749 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.654 ' O ' HG21 ' A' ' 51' ' ' VAL . 8.2 mp -129.43 142.41 50.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.489 -179.471 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.9 p-10 -77.92 155.67 30.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.803 179.914 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.47 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 50.6 pt -133.55 165.02 33.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.478 179.59 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 40.0 mttp -115.76 165.73 12.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.062 0.458 . . . . 0.0 111.146 -179.652 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.548 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 22.4 pttp -64.97 -14.14 59.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.629 -179.328 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -138.92 25.72 2.51 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.189 179.738 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 80.8 tt0 -100.77 138.54 37.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.104 0.478 . . . . 0.0 110.967 -179.95 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.519 ' C ' HD22 ' A' ' 29' ' ' LEU . 82.6 mtm180 -94.1 123.17 37.3 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.927 -179.853 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.692 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -115.72 150.2 37.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.889 0.376 . . . . 0.0 111.1 -179.668 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.473 ' HD1' HG12 ' A' ' 6' ' ' ILE . 7.5 m-90 -101.38 111.73 24.04 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.267 179.917 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.506 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 72.0 mt -74.84 148.56 40.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.945 0.402 . . . . 0.0 111.416 -179.794 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.4 mp -111.31 -27.22 8.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.67 179.454 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -161.87 118.38 2.09 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.595 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.457 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 35.0 p-10 -110.02 6.76 23.29 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.655 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 84.0 p -71.87 -35.5 69.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.957 0.408 . . . . 0.0 111.212 -179.715 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -83.63 157.56 22.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.715 -179.491 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 92.8 m -57.32 -35.52 69.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.199 178.315 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -97.5 128.54 44.34 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.6 177.854 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.457 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 42.2 m0 -99.03 140.23 33.5 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -177.903 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.545 ' HG2' HD13 ' A' ' 32' ' ' LEU . 47.8 ttt180 -99.56 134.47 42.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.075 -0.966 . . . . 0.0 108.778 178.081 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.692 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.5 OUTLIER -136.53 161.92 36.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.924 0.392 . . . . 0.0 111.8 -178.455 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.463 ' HB2' HG22 ' A' ' 48' ' ' THR . 37.9 ttp-105 -126.5 143.06 51.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.091 179.658 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.537 ' ND2' ' HB3' ' A' ' 45' ' ' ALA . 44.4 p-10 -110.81 169.39 8.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.55 -179.452 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.85 -22.57 64.36 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.355 179.827 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.537 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . . . -73.73 5.79 3.72 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.793 179.214 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 67.58 22.65 9.09 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 121.015 0.436 . . . . 0.0 110.957 -179.264 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -109.43 137.97 46.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.306 179.335 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.463 HG22 ' HB2' ' A' ' 42' ' ' ARG . 52.2 p -121.52 161.56 22.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.752 0.311 . . . . 0.0 110.988 -179.803 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -177.33 174.77 47.24 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.692 -179.876 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.532 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 95.6 m-85 -107.7 111.23 23.33 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.783 0.325 . . . . 0.0 111.386 -179.684 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.654 HG21 ' O ' ' A' ' 21' ' ' LEU . 21.5 t -122.41 109.54 32.89 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.189 179.609 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.05 32.64 0.27 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.214 1.943 . . . . 0.0 112.313 178.876 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.541 ' HB2' HG12 ' A' ' 51' ' ' VAL . 8.8 t -72.93 87.01 1.31 Allowed 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 120.948 0.404 . . . . 0.0 111.065 -179.675 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.7 m120 -67.14 -8.66 32.67 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.757 178.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -63.34 -10.08 14.86 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.856 179.418 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.625 HG23 ' C ' ' A' ' 8' ' ' ILE . 5.6 p -118.05 142.11 34.05 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-O 120.895 0.378 . . . . 0.0 110.801 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.412 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 84.8 tt0 -147.04 159.56 43.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.824 -179.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.676 ' HB3' HG12 ' A' ' 7' ' ' VAL . 29.4 ptt180 -71.43 144.44 49.75 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.798 0.332 . . . . 0.0 111.18 179.836 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.9 tttt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.19 -0.909 . . . . 0.0 110.716 179.341 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.8 ttp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.841 0.353 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 64.5 p -77.95 153.2 32.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.978 179.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -90.58 -6.97 54.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.664 179.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -70.69 141.42 51.6 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.068 0.461 . . . . 0.0 110.963 179.819 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.477 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 58.4 t -112.61 130.82 65.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.442 179.948 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.1 mt -115.35 119.28 61.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.167 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.733 HG12 ' HA ' ' A' ' 58' ' ' ARG . 28.0 m -132.16 161.13 41.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.08 179.477 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 28.0 mm -116.55 127.85 74.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.435 179.534 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.23 148.18 39.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.553 -179.669 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.444 ' O ' ' HG3' ' A' ' 25' ' ' LYS . 63.6 mttp -113.6 -16.83 12.29 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.671 179.951 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.532 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 16.1 m-90 -142.42 137.97 30.75 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.102 0.477 . . . . 0.0 110.655 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -63.62 123.74 19.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.035 -178.863 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.49 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 55.5 t80 -127.89 139.55 52.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.63 -179.613 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.15 138.62 40.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.191 179.212 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.74 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.27 127.42 29.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.445 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.41 ' OE1' ' CZ3' ' A' ' 38' ' ' TRP . 96.0 mt-30 -62.36 -35.02 77.82 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.148 0.499 . . . . 0.0 110.367 179.678 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -129.3 162.0 28.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.097 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -61.89 -34.66 76.44 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.014 0.435 . . . . 0.0 111.157 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -63.11 -24.75 68.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.444 -179.823 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.74 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.3 mm-40 -81.04 -179.58 7.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.117 0.485 . . . . 0.0 110.131 179.621 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.76 HD21 ' HB3' ' A' ' 43' ' ' ASN . 6.9 tp -119.42 144.58 46.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.517 -178.524 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -85.31 143.57 28.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.761 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.497 HD11 ' OG ' ' A' ' 53' ' ' SER . 38.8 pt -131.0 162.92 38.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.651 179.539 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 72.0 mmtt -110.97 176.2 5.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.163 0.506 . . . . 0.0 111.064 179.691 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.517 ' HG3' ' HA ' ' A' ' 11' ' ' TRP . 28.6 ttpp -63.08 -45.91 89.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.841 -178.827 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.0 p-10 -109.76 -0.25 18.55 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.505 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 78.5 tt0 -64.63 145.3 56.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.423 0.63 . . . . 0.0 111.19 -179.405 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.448 ' C ' HD22 ' A' ' 29' ' ' LEU . 22.4 ptt-85 -99.26 121.96 41.77 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.533 -179.992 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.738 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.0 mm? -113.38 146.55 39.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.555 -179.099 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.411 ' C ' HG23 ' A' ' 41' ' ' VAL . 4.4 m-90 -102.11 108.35 19.73 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.268 179.804 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.477 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 83.8 mt -75.04 150.75 38.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.033 0.444 . . . . 0.0 111.638 -179.517 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -112.63 -28.43 7.82 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.664 179.55 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -160.99 118.47 2.36 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.853 0.359 . . . . 0.0 110.768 179.763 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.484 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 32.7 p-10 -106.84 1.23 24.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.282 -179.765 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.4 m -63.9 -37.36 87.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.889 0.376 . . . . 0.0 111.687 -179.435 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -81.91 158.67 23.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.148 -179.133 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 88.7 m -58.96 -37.01 75.78 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 177.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.41 ' CZ3' ' OE1' ' A' ' 16' ' ' GLN . 26.7 m95 -96.37 129.35 43.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 114.954 -1.021 . . . . 0.0 108.51 177.697 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.484 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 36.2 m0 -99.21 138.78 35.82 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.825 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.448 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 69.7 ttt180 -97.04 132.77 42.51 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.188 178.378 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.738 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.1 p -140.83 155.91 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.732 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -178.143 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.554 ' HG3' HG22 ' A' ' 48' ' ' THR . 37.4 ttm180 -125.23 140.16 53.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.69 -179.282 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.76 ' HB3' HD21 ' A' ' 21' ' ' LEU . 47.6 p-10 -108.92 172.13 7.03 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.174 0.512 . . . . 0.0 111.749 179.687 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.2 -24.34 67.16 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.168 179.188 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.598 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -73.36 3.47 5.88 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 179.472 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.6 t30 69.57 24.96 5.42 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 120.861 0.362 . . . . 0.0 111.28 -179.89 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.598 ' NH1' ' HB1' ' A' ' 45' ' ' ALA . 81.5 mtt85 -112.98 136.07 53.06 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.087 179.133 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.554 HG22 ' HG3' ' A' ' 42' ' ' ARG . 31.4 p -125.0 156.76 37.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.042 0.449 . . . . 0.0 111.704 -179.026 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -173.26 173.16 45.61 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.458 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.448 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 93.7 m-85 -102.66 110.12 21.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.882 0.372 . . . . 0.0 110.462 179.836 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.533 HG21 ' O ' ' A' ' 21' ' ' LEU . 13.1 t -121.98 110.14 33.27 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.658 -179.737 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -73.99 35.87 0.39 Allowed 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 121.824 1.682 . . . . 0.0 112.46 177.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.576 ' O ' HG12 ' A' ' 56' ' ' VAL . 23.1 t -68.54 87.52 0.32 Allowed 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 120.826 0.345 . . . . 0.0 111.074 -179.44 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -59.83 -18.33 43.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.188 0.518 . . . . 0.0 110.062 177.54 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.532 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.9 m-85 -56.0 -17.05 5.78 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.657 179.589 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.576 HG12 ' O ' ' A' ' 53' ' ' SER . 7.1 p -113.07 142.98 23.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 CA-C-O 121.047 0.451 . . . . 0.0 110.86 -179.821 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.409 ' HG2' ' N ' ' A' ' 58' ' ' ARG . 86.2 tt0 -141.86 159.94 41.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.766 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.733 ' HA ' HG12 ' A' ' 7' ' ' VAL . 78.8 mtp180 -69.59 141.62 53.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.835 -179.965 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.721 179.58 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.0 ttm . . . . . 0 N--CA 1.49 1.539 0 CA-C-O 120.83 0.348 . . . . 0.0 111.376 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 60.3 p -97.89 129.74 44.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.017 0.437 . . . . 0.0 111.041 179.723 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -100.97 127.62 47.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.759 179.678 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -71.47 144.43 49.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.012 0.434 . . . . 0.0 110.846 179.889 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.48 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 62.8 t -110.21 128.65 66.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.42 179.836 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.6 mm -98.42 117.38 43.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.994 -179.711 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.806 HG12 ' CA ' ' A' ' 58' ' ' ARG . 34.1 m -135.12 162.3 38.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.145 0.498 . . . . 0.0 112.05 -179.699 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.591 ' C ' HG23 ' A' ' 56' ' ' VAL . 15.4 mt -122.51 124.08 69.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.798 -179.464 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.614 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -76.59 119.94 21.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.073 0.463 . . . . 0.0 111.702 -179.491 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -91.56 -7.68 49.56 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.169 -179.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.72 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 15.9 m-90 -142.41 143.74 32.8 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.919 0.39 . . . . 0.0 110.536 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.7 p-10 -74.16 121.54 21.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.364 -179.13 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.447 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 60.9 t80 -127.91 138.22 52.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.67 179.914 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.3 t -101.41 142.57 32.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.768 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.776 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -58.03 132.42 53.43 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.836 -179.717 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.408 ' OE1' ' CH2' ' A' ' 38' ' ' TRP . 92.8 mt-30 -66.75 -30.38 70.58 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 121.131 0.491 . . . . 0.0 110.244 179.165 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -132.66 161.42 33.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.125 179.448 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -62.29 -31.95 72.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.895 0.379 . . . . 0.0 111.9 -179.163 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -71.17 -15.39 62.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.72 -179.744 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.776 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.4 mm-40 -84.79 -178.97 7.0 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.356 -179.388 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.883 HD21 ' HB2' ' A' ' 43' ' ' ASN . 13.1 tp -125.79 123.87 39.73 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -177.884 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -68.43 152.67 45.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.716 179.401 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.447 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 45.5 pt -133.98 162.13 39.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.098 179.249 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -117.11 164.84 14.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.285 0.564 . . . . 0.0 111.22 -179.934 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 52.0 pttt -64.54 -13.49 52.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.954 -179.591 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -140.72 24.77 2.21 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.331 179.643 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.556 ' HG2' HD22 ' A' ' 29' ' ' LEU . 80.5 tt0 -102.25 135.64 43.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.158 0.504 . . . . 0.0 110.871 179.845 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.487 ' HG2' HG23 ' A' ' 8' ' ' ILE . 87.0 mtm-85 -89.49 120.71 31.05 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.69 179.984 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.61 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.8 mm? -110.95 145.89 37.57 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.131 -177.792 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 27.1 m-90 -99.73 105.05 16.81 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.611 0.243 . . . . 0.0 111.216 179.173 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.48 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 96.1 mt -76.22 148.63 37.53 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.116 0.484 . . . . 0.0 111.2 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.559 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.1 mp -112.77 -32.38 6.43 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.624 179.902 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -156.99 114.72 3.17 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.396 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.458 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 29.9 p-10 -109.27 1.79 20.4 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -179.035 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 69.4 m -65.02 -36.02 83.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.876 0.37 . . . . 0.0 111.584 -179.626 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -82.42 158.33 23.33 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.509 0.671 . . . . 0.0 112.488 -179.042 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 20.1 p -55.58 -39.42 70.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.354 178.112 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.408 ' CH2' ' OE1' ' A' ' 16' ' ' GLN . 28.8 m95 -93.26 133.28 36.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.759 -1.11 . . . . 0.0 108.285 177.24 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.458 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 33.9 m0 -105.48 131.35 53.01 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -177.871 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.465 ' HG2' HD13 ' A' ' 32' ' ' LEU . 29.6 ttp180 -91.06 133.11 35.58 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.753 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.61 HG21 ' HB3' ' A' ' 29' ' ' LEU . 2.7 p -143.61 159.72 16.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 C-N-CA 120.268 -0.573 . . . . 0.0 112.257 -177.554 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.727 ' HA ' HG22 ' A' ' 48' ' ' THR . 44.2 ttp180 -119.57 152.65 36.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.456 -179.08 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.883 ' HB2' HD21 ' A' ' 21' ' ' LEU . 58.4 t30 -120.46 159.73 24.55 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 120.749 0.309 . . . . 0.0 111.058 179.418 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.56 -21.34 52.47 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.849 178.765 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.424 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -80.45 5.7 14.37 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.171 179.19 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.8 m120 70.07 22.28 5.75 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 122.592 0.357 . . . . 0.0 111.311 -179.249 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.424 ' NH1' ' HB1' ' A' ' 45' ' ' ALA . 82.7 mtt85 -109.16 127.31 54.09 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.055 178.808 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.727 HG22 ' HA ' ' A' ' 42' ' ' ARG . 63.4 p -123.12 151.06 42.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.148 -179.61 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.439 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.57 174.9 40.63 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.561 179.856 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -105.16 110.88 23.43 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 117.0 0.4 . . . . 0.0 111.93 -179.436 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.56 HG13 ' HB3' ' A' ' 20' ' ' GLU . 16.0 m -132.46 115.45 14.85 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.12 178.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.35 43.58 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.773 1.649 . . . . 0.0 111.966 178.878 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.7 m -63.76 97.07 0.14 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.019 0.438 . . . . 0.0 110.462 -179.78 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -72.24 -15.67 61.93 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.498 179.093 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.72 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 89.2 m-85 -69.1 -10.47 57.79 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.452 -179.536 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.614 HG23 ' HA ' ' A' ' 9' ' ' ALA . 9.2 p -113.24 139.73 37.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 O-C-N 121.732 -0.605 . . . . 0.0 110.781 179.358 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -144.94 160.05 41.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.357 -179.81 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.806 ' CA ' HG12 ' A' ' 7' ' ' VAL . 36.9 ptt-85 -70.13 137.2 50.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.266 -179.475 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 61.9 tttm . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.744 179.81 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.8 mtp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.719 0.295 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.5 m -81.93 128.5 34.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.056 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -100.46 138.11 37.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.955 179.995 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -98.77 139.35 34.6 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.259 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.53 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 56.0 t -117.48 129.14 74.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.511 179.833 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.402 HG12 ' HD1' ' A' ' 30' ' ' TRP . 22.8 mt -104.73 121.01 56.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.825 179.816 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.677 HG12 ' HB3' ' A' ' 58' ' ' ARG . 25.5 m -132.72 161.07 42.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.97 0.414 . . . . 0.0 111.781 -179.798 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.705 ' C ' HG23 ' A' ' 56' ' ' VAL . 16.9 mt -120.99 128.05 76.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.005 -179.918 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -77.64 127.26 32.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.004 -179.988 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -93.74 -13.31 27.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.449 179.596 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.475 ' CA ' ' HA ' ' A' ' 25' ' ' LYS . 7.3 m-90 -140.58 154.12 46.37 Favored 'General case' 0 CA--C 1.528 0.1 0 CA-C-O 120.999 0.428 . . . . 0.0 111.311 -179.699 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.473 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 11.4 t70 -76.58 123.82 26.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.525 -179.493 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.477 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 63.3 t80 -127.97 140.36 52.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.157 -179.776 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.1 m -104.19 138.02 41.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.703 179.571 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.61 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -59.0 138.03 57.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.784 -179.814 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -86.77 -0.27 56.06 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.455 178.703 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.531 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 78.1 mt-30 -147.75 167.42 24.73 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.135 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -73.67 -29.97 62.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.007 0.432 . . . . 0.0 111.361 -179.638 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -76.25 -14.94 60.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.208 -179.393 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.61 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -85.79 178.08 7.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.915 0.388 . . . . 0.0 111.04 -179.467 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.57 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.6 mp -124.85 141.64 51.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.3 0.572 . . . . 0.0 111.481 -178.19 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -80.77 147.78 30.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.746 179.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.477 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 47.0 pt -129.2 164.88 30.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.222 179.228 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.437 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 68.8 mttm -116.5 176.78 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.18 0.514 . . . . 0.0 112.037 -179.095 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.475 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 28.1 mttt -61.7 -30.17 70.57 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.838 -179.871 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -133.78 53.34 2.01 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.064 0.459 . . . . 0.0 110.903 -179.483 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.452 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 80.2 tt0 -117.08 137.69 52.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.038 179.937 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.53 ' HG2' HG12 ' A' ' 8' ' ' ILE . 94.0 mtm-85 -96.77 122.79 40.11 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.197 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.713 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER -117.04 147.88 41.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.081 -179.873 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.402 ' HD1' HG12 ' A' ' 6' ' ' ILE . 5.2 m-90 -99.99 106.53 18.33 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.209 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.53 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 80.0 mt -76.24 146.39 39.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.094 0.473 . . . . 0.0 111.633 -179.401 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.573 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.3 mp -111.69 -30.51 7.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.753 179.639 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -161.01 120.13 2.57 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.474 179.548 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.48 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.1 p-10 -110.84 1.54 17.74 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -179.46 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.7 m -63.41 -39.04 93.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.741 0.305 . . . . 0.0 111.532 -179.576 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -81.72 158.82 24.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.007 0.432 . . . . 0.0 111.656 -179.511 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -56.9 -35.01 68.49 Favored 'General case' 0 C--N 1.333 -0.118 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 178.077 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.602 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 61.2 m95 -96.92 129.38 44.38 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.453 177.668 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.495 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 39.4 m0 -104.17 132.71 50.14 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -177.662 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.572 ' HG2' HD13 ' A' ' 32' ' ' LEU . 65.5 ttt180 -87.92 134.12 33.78 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.592 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.713 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.2 p -139.73 161.22 27.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.761 -178.796 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.46 ' CB ' HG22 ' A' ' 48' ' ' THR . 42.9 ttm180 -125.54 142.01 51.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.837 -179.715 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -111.88 165.63 11.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.471 -179.523 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.69 -27.67 65.04 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.448 -179.958 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -72.8 5.11 3.42 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.886 179.191 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.6 m120 69.23 25.68 5.61 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.002 0.43 . . . . 0.0 111.058 -179.659 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.548 ' O ' HD21 ' A' ' 21' ' ' LEU . 21.8 ttt180 -110.72 131.5 55.0 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.221 179.227 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.46 HG22 ' CB ' ' A' ' 42' ' ' ARG . 75.7 p -119.73 156.87 29.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.146 -179.818 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.46 177.7 44.94 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.103 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.567 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 84.0 m-85 -108.73 115.01 29.28 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.464 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.57 HG11 ' O ' ' A' ' 21' ' ' LEU . 12.6 m -128.59 110.32 19.06 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.601 179.407 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.602 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 57.9 Cg_endo -72.41 32.41 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.406 2.071 . . . . 0.0 112.218 178.481 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.462 ' O ' HG12 ' A' ' 56' ' ' VAL . 11.7 t -68.4 84.81 0.27 Allowed 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.471 -179.917 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -64.65 -11.3 33.92 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.866 178.743 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 99.5 m-85 -62.93 -9.84 11.32 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 179.591 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.705 HG23 ' C ' ' A' ' 8' ' ' ILE . 6.2 p -117.91 139.1 46.37 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-O 121.022 0.439 . . . . 0.0 110.679 179.663 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -142.54 161.9 36.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.624 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.677 ' HB3' HG12 ' A' ' 7' ' ' VAL . 33.2 ptt-85 -71.14 141.12 50.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.875 0.369 . . . . 0.0 111.218 -179.803 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.6 tttt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.142 -0.932 . . . . 0.0 110.671 179.551 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.1 mtp . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 120.787 0.327 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 82.6 p -88.87 -3.83 58.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.485 179.812 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -98.83 137.17 37.8 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.972 0.415 . . . . 0.0 110.99 179.969 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -86.73 141.16 29.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.211 0.529 . . . . 0.0 111.14 -179.943 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.416 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.0 t -109.31 130.97 61.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.553 179.805 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.2 mt -115.37 118.38 58.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.333 -179.647 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.722 HG12 ' HA ' ' A' ' 58' ' ' ARG . 29.1 m -132.14 160.21 42.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.941 0.4 . . . . 0.0 111.278 179.437 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.553 ' C ' HG23 ' A' ' 56' ' ' VAL . 35.3 mt -116.75 126.87 74.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.472 179.577 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.585 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.0 149.83 39.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.587 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -112.37 -20.65 11.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.183 -179.915 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.514 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 16.4 m-90 -140.42 150.58 44.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.641 -179.944 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.48 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 50.9 t0 -72.97 124.57 25.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.346 -179.322 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 57.1 t80 -127.52 133.89 49.81 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.577 179.621 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 61.5 m -101.51 139.15 37.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.047 0.451 . . . . 0.0 111.104 -179.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.796 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -55.23 129.72 39.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.693 -179.905 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -65.53 -31.8 73.05 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.118 0.485 . . . . 0.0 110.008 179.345 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -130.99 163.81 26.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.114 179.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -64.61 -34.69 78.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.97 0.414 . . . . 0.0 111.266 -179.622 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -65.1 -19.39 65.96 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.444 -179.882 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.796 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.9 mm-40 -82.63 -178.93 7.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.65 0.262 . . . . 0.0 111.175 -179.803 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.946 HD21 ' HB2' ' A' ' 43' ' ' ASN . 26.1 tp -120.79 134.44 55.29 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.161 0.505 . . . . 0.0 112.167 -178.326 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -78.86 145.64 34.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.15 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.48 HG22 HD11 ' A' ' 29' ' ' LEU . 31.3 pt -132.66 163.82 36.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.071 179.129 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 90.6 mttt -114.6 -176.74 2.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.232 0.539 . . . . 0.0 111.514 -179.545 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.48 ' HG2' ' HB2' ' A' ' 12' ' ' ASP . 63.6 mttt -63.37 -57.47 10.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.938 -179.494 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -100.02 -12.73 19.48 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.47 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 77.1 tt0 -51.83 143.15 13.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.886 0.374 . . . . 0.0 111.681 -178.989 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.547 ' C ' HD22 ' A' ' 29' ' ' LEU . 98.1 mtt180 -97.78 124.99 42.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.977 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.758 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.7 mm? -114.27 143.3 45.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.064 0.459 . . . . 0.0 111.695 -179.254 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.449 ' O ' HD22 ' A' ' 32' ' ' LEU . 4.0 m-90 -101.42 105.87 16.94 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.557 179.727 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.531 ' C ' HD22 ' A' ' 32' ' ' LEU . 79.3 mt -69.87 149.87 47.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.303 0.573 . . . . 0.0 111.936 -179.024 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.667 HD23 ' HA ' ' A' ' 41' ' ' VAL . 3.6 mm? -119.29 -31.88 4.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.797 -178.23 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -113.28 -83.74 0.6 Allowed 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.114 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.514 ' HA ' ' CD1' ' A' ' 39' ' ' TRP . 18.2 m-20 72.01 3.84 4.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.899 -179.418 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.1 m -82.5 -36.04 26.82 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.886 0.374 . . . . 0.0 111.151 179.883 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -104.17 168.84 8.85 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.997 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 16.0 m -55.68 -30.31 60.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.673 178.494 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -97.56 126.97 43.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.854 178.253 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.514 ' CD1' ' HA ' ' A' ' 34' ' ' ASP . 42.5 m0 -106.88 134.22 50.35 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -177.582 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.483 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 58.4 ttp180 -92.24 127.21 37.63 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 177.475 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.758 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -135.1 161.73 39.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -178.293 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.458 ' HA ' HG22 ' A' ' 48' ' ' THR . 57.1 ttm-85 -123.25 139.9 53.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.713 -179.547 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.946 ' HB2' HD21 ' A' ' 21' ' ' LEU . 52.4 t30 -110.34 161.57 15.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.864 0.364 . . . . 0.0 111.274 179.878 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.25 -21.03 46.77 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.552 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -79.93 5.03 14.97 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.836 179.735 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 72.78 22.57 3.1 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.852 0.358 . . . . 0.0 111.001 -179.637 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.4 ' C ' HD13 ' A' ' 21' ' ' LEU . 99.7 mtt180 -107.23 132.44 53.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.158 179.242 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.458 HG22 ' HA ' ' A' ' 42' ' ' ARG . 73.2 p -127.27 151.0 49.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.696 0.284 . . . . 0.0 111.079 -179.592 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.497 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -170.5 172.84 44.27 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.577 -0.821 . . . . 0.0 113.115 -179.973 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.483 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 85.8 m-85 -101.52 114.04 27.7 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.641 0.258 . . . . 0.0 111.134 -179.905 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.518 HG13 ' HB3' ' A' ' 20' ' ' GLU . 15.7 m -136.05 114.15 10.77 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.737 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.24 43.21 0.84 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.164 1.909 . . . . 0.0 111.865 178.618 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.504 ' O ' HG12 ' A' ' 56' ' ' VAL . 88.6 p -71.07 90.3 0.85 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.001 0.429 . . . . 0.0 111.282 -179.383 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -66.21 -12.68 57.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.371 178.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.514 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 96.0 m-85 -62.63 -12.95 26.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.055 -0.521 . . . . 0.0 112.159 -179.995 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.585 HG23 ' HA ' ' A' ' 9' ' ' ALA . 7.2 p -115.35 141.18 33.3 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.099 0 CA-C-O 120.95 0.405 . . . . 0.0 110.695 179.723 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -137.94 164.73 28.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.331 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.722 ' HA ' HG12 ' A' ' 7' ' ' VAL . 17.1 mtp-105 -69.93 143.88 52.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.66 179.745 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.142 -0.932 . . . . 0.0 110.992 179.947 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.4 mtp . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.874 0.369 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 75.6 p -79.37 153.88 29.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.966 179.887 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -80.84 149.12 29.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.852 179.817 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -94.8 136.85 34.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.094 0.474 . . . . 0.0 111.164 -179.864 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.445 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.5 t -117.45 131.53 69.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.708 179.915 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.7 mt -113.87 116.06 51.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.98 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.661 HG12 ' HB3' ' A' ' 58' ' ' ARG . 23.0 m -132.23 161.1 41.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.837 0.351 . . . . 0.0 111.568 179.923 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.964 HD12 ' HD2' ' A' ' 59' ' ' LYS . 15.5 mt -119.0 123.0 70.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.288 -179.668 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.676 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.62 123.58 25.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.631 -179.718 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.472 ' HE3' ' HE2' ' A' ' 59' ' ' LYS . 38.8 mttp -93.7 -10.63 33.74 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.081 -179.955 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.787 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 11.1 m-90 -140.74 145.11 35.99 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.944 0.402 . . . . 0.0 110.839 179.841 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -72.81 122.21 21.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.083 -179.281 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.463 ' CD1' ' HB3' ' A' ' 53' ' ' SER . 57.5 t80 -127.55 139.77 52.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.101 179.99 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 91.1 m -103.02 138.96 39.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.675 179.742 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.62 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -61.88 139.23 58.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.519 -179.667 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -87.83 -1.23 57.84 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.464 179.23 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.498 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 93.1 mt-30 -145.99 169.71 18.08 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 178.791 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -75.13 -33.36 61.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.106 0.479 . . . . 0.0 110.945 -179.645 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -71.43 -16.32 62.38 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.925 -179.635 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.62 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 0.4 OUTLIER -86.56 178.73 6.98 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.022 -179.649 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.46 ' O ' HG11 ' A' ' 51' ' ' VAL . 7.1 mp -129.59 139.04 51.57 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-O 121.098 0.475 . . . . 0.0 111.859 -177.754 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -74.72 148.55 40.41 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.852 179.324 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.447 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 41.8 pt -129.29 164.0 32.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.911 179.221 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.445 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 96.9 mttt -118.99 163.64 16.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.141 0.496 . . . . 0.0 111.141 -179.858 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.485 ' HA ' ' N ' ' A' ' 11' ' ' TRP . 10.8 pttm -63.87 -10.53 21.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.52 -0.764 . . . . 0.0 113.029 -179.804 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -140.68 26.4 2.11 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.013 179.494 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.454 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 82.4 tt0 -102.03 143.11 32.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.046 0.45 . . . . 0.0 110.705 179.899 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.495 ' C ' HD22 ' A' ' 29' ' ' LEU . 82.6 mtm-85 -95.33 119.41 33.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.291 -179.523 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.673 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -116.12 145.21 43.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.128 -179.661 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -100.92 107.53 19.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.492 -179.675 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.445 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 63.6 mt -77.9 149.66 34.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.119 0.485 . . . . 0.0 111.538 -179.583 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.498 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.8 mp -114.55 -29.84 6.71 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.039 179.795 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -157.05 115.0 3.19 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.883 0.373 . . . . 0.0 110.601 179.772 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.495 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 35.7 p-10 -106.28 2.34 26.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.229 -179.49 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 87.6 p -67.67 -37.63 82.62 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.904 0.383 . . . . 0.0 111.904 -179.351 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -81.61 162.08 23.24 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.328 0.585 . . . . 0.0 112.38 -179.044 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.491 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 17.1 p -57.55 -39.74 77.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.856 177.838 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.508 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 54.3 m95 -96.97 130.21 44.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.47 -1.241 . . . . 0.0 108.745 177.791 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.495 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 38.2 m0 -102.62 132.97 48.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -177.862 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.485 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 51.9 ttt180 -87.45 132.07 34.12 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 177.794 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.673 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.8 OUTLIER -138.9 157.12 28.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.926 0.393 . . . . 0.0 111.81 -178.724 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.435 ' CB ' HG22 ' A' ' 48' ' ' THR . 43.4 ttm180 -119.49 142.97 47.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.988 -179.664 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -113.08 163.16 15.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.391 -179.502 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.23 -20.68 43.73 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.463 179.769 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.603 ' HB1' ' NH1' ' A' ' 47' ' ' ARG . . . -77.79 5.79 8.8 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 179.679 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 29.1 m120 68.48 26.92 6.43 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 120.948 0.404 . . . . 0.0 111.307 -179.903 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.603 ' NH1' ' HB1' ' A' ' 45' ' ' ALA . 83.3 mtt85 -115.05 144.5 43.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.55 178.719 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.435 HG22 ' CB ' ' A' ' 42' ' ' ARG . 75.5 p -129.74 153.91 47.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.568 0.223 . . . . 0.0 110.715 -179.867 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -169.02 176.12 43.24 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.552 -179.728 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.485 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 94.7 m-85 -108.13 114.6 28.62 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.217 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.55 HG13 ' HB3' ' A' ' 20' ' ' GLU . 6.0 m -133.16 111.22 12.98 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.812 179.255 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.508 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 13.7 Cg_exo -70.18 41.16 0.34 Allowed 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.734 2.29 . . . . 0.0 112.502 178.487 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.598 ' O ' HG12 ' A' ' 56' ' ' VAL . 6.7 p -69.03 74.19 0.3 Allowed 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 120.676 0.274 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -54.13 -17.51 2.82 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.146 -0.346 . . . . 0.0 111.223 178.708 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.787 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 91.1 m-85 -61.43 -8.06 3.71 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 179.26 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.676 HG23 ' HA ' ' A' ' 9' ' ' ALA . 9.2 p -111.2 140.15 31.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 O-C-N 121.386 -0.821 . . . . 0.0 110.727 179.808 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -136.55 150.57 48.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.224 179.803 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.661 ' HB3' HG12 ' A' ' 7' ' ' VAL . 33.6 ptt-85 -72.0 147.26 47.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.315 -179.465 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.964 ' HD2' HD12 ' A' ' 8' ' ' ILE . 98.5 mttt . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.306 -0.854 . . . . 0.0 110.82 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.5 ttm . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 80.5 p -80.25 147.73 31.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.1 -179.983 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -100.13 130.96 46.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.01 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -93.19 132.71 37.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.039 0.447 . . . . 0.0 111.212 -179.955 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.485 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 79.2 t -118.67 129.13 75.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.785 -179.9 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 10.5 mt -105.59 114.71 45.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.712 0.291 . . . . 0.0 111.751 179.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.722 HG12 ' HA ' ' A' ' 58' ' ' ARG . 30.8 m -132.98 159.46 43.17 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.741 0.305 . . . . 0.0 110.987 179.054 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.613 ' HB ' ' HD2' ' A' ' 59' ' ' LYS . 54.3 mt -121.5 124.28 71.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.062 0.458 . . . . 0.0 111.395 179.96 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.688 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -75.13 124.76 27.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.085 -179.989 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -93.08 -9.18 40.5 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.837 -179.992 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.813 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 14.3 m-90 -143.58 147.06 33.84 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.866 0.365 . . . . 0.0 110.473 179.431 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.3 p-10 -73.67 124.04 25.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.438 -178.719 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.46 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 46.3 t80 -128.64 135.09 48.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.511 179.173 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 66.8 m -100.36 139.88 35.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.267 0.556 . . . . 0.0 111.489 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.825 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.43 130.51 46.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.488 179.813 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -65.16 -28.21 69.25 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.015 0.436 . . . . 0.0 110.246 179.106 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -135.45 162.33 32.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.111 179.36 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -64.16 -29.91 71.0 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.904 0.383 . . . . 0.0 111.274 -179.705 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -69.48 -19.25 63.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.634 -179.757 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.825 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.3 mm-40 -82.55 -177.56 6.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.512 179.888 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.916 HD21 ' HB2' ' A' ' 43' ' ' ASN . 20.3 tp -123.7 133.14 53.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.138 0.494 . . . . 0.0 111.692 -178.913 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -77.65 148.56 34.97 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.806 179.605 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.472 HG22 ' HG ' ' A' ' 29' ' ' LEU . 36.6 pt -131.93 163.56 37.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.335 179.39 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 9' ' ' ALA . 73.4 mmtt -118.38 164.2 15.6 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.144 0.497 . . . . 0.0 111.352 179.919 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.5 ' HA ' ' CA ' ' A' ' 11' ' ' TRP . 33.4 pttt -65.74 -11.11 42.91 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -179.671 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -140.6 23.34 2.3 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.168 179.638 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.472 ' HG2' ' CD2' ' A' ' 29' ' ' LEU . 78.6 tt0 -102.62 139.73 37.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.067 0.46 . . . . 0.0 110.695 179.939 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.58 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 11.9 ptp180 -95.25 121.38 36.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.212 179.953 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.658 ' HB3' HG21 ' A' ' 41' ' ' VAL . 0.9 OUTLIER -113.58 152.69 29.96 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.517 -178.966 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.428 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 11.2 m-90 -103.36 105.57 15.87 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.501 -179.661 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.485 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 71.8 mt -77.63 146.34 36.19 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.076 0.465 . . . . 0.0 111.865 -179.335 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.569 HD13 ' HG2' ' A' ' 40' ' ' ARG . 4.9 mp -110.63 -29.53 7.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.203 179.976 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -158.96 116.74 2.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.865 0.364 . . . . 0.0 110.698 -179.672 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.485 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 42.6 p-10 -108.83 4.49 23.62 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.177 -0.465 . . . . 0.0 112.114 -179.381 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.7 m -68.32 -35.57 77.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.84 0.352 . . . . 0.0 111.383 -179.429 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -84.27 158.4 21.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.071 -179.162 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.476 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 19.3 p -55.36 -40.65 71.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.337 -0.847 . . . . 0.0 108.841 177.74 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.595 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 56.2 m95 -93.84 129.28 40.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.452 -1.249 . . . . 0.0 109.102 177.845 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.491 ' O ' ' HA ' ' A' ' 50' ' ' TYR . 37.4 m0 -101.16 137.61 39.29 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.055 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.569 ' HG2' HD13 ' A' ' 32' ' ' LEU . 64.5 ttt180 -93.03 135.36 34.27 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 177.443 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.658 HG21 ' HB3' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -145.63 159.19 12.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.533 -0.467 . . . . 0.0 111.569 -178.935 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.633 ' HA ' HG22 ' A' ' 48' ' ' THR . 78.1 ttt180 -124.02 144.08 50.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.154 179.999 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.916 ' HB2' HD21 ' A' ' 21' ' ' LEU . 54.7 t30 -113.43 163.35 14.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.308 179.855 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.42 -24.7 63.7 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.662 -179.974 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.28 5.72 8.03 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.691 179.059 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 71.92 20.55 4.41 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.314 0.245 . . . . 0.0 111.08 -179.813 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -105.89 125.16 50.66 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.597 179.644 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.633 HG22 ' HA ' ' A' ' 42' ' ' ARG . 76.9 p -121.13 149.86 42.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.126 -179.732 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.424 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.62 176.74 40.43 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.639 179.719 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.491 ' HA ' ' O ' ' A' ' 39' ' ' TRP . 85.7 m-85 -107.64 110.85 22.83 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.878 0.339 . . . . 0.0 111.579 -179.87 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.654 HG13 ' HB3' ' A' ' 20' ' ' GLU . 12.1 m -134.08 117.05 13.55 Favored Pre-proline 0 CA--C 1.534 0.335 0 N-CA-C 111.493 0.183 . . . . 0.0 111.493 179.515 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.595 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 57.6 Cg_endo -71.75 53.47 1.87 Allowed 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.319 2.013 . . . . 0.0 111.613 179.111 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.646 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.8 m -66.92 92.99 0.25 Allowed 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.093 -179.513 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 29.3 m120 -77.26 -10.4 59.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.902 0.382 . . . . 0.0 110.186 178.055 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.813 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 86.1 m-85 -81.37 6.24 15.03 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.323 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.688 HG23 ' HA ' ' A' ' 9' ' ' ALA . 13.2 p -118.08 144.66 25.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 O-C-N 121.946 -0.472 . . . . 0.0 110.51 179.591 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -128.09 156.82 42.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.824 -179.674 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.722 ' HA ' HG12 ' A' ' 7' ' ' VAL . 17.1 mtp-105 -73.43 142.44 46.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.793 -179.904 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.613 ' HD2' ' HB ' ' A' ' 8' ' ' ILE . 56.3 mttm . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.876 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.1 mtm . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.4 m -80.51 138.85 36.57 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.811 0.339 . . . . 0.0 110.866 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -90.89 139.07 31.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.864 -179.955 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -99.59 138.28 36.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.092 0.472 . . . . 0.0 111.195 -179.856 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.428 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 58.6 t -111.92 130.16 66.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.32 179.716 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.44 HG12 ' CD1' ' A' ' 30' ' ' TRP . 50.3 mt -111.28 117.39 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.008 179.8 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.794 HG12 ' CA ' ' A' ' 58' ' ' ARG . 32.9 m -131.18 160.79 42.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.071 179.646 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.581 ' C ' HG23 ' A' ' 56' ' ' VAL . 16.8 mt -119.84 122.17 67.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.822 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.496 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -77.01 124.33 27.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.265 -179.925 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.456 ' CE ' ' HE2' ' A' ' 59' ' ' LYS . 94.8 mttt -92.97 -11.05 34.21 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.905 179.813 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.706 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 9.2 m-90 -140.42 146.51 38.4 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.744 0.307 . . . . 0.0 110.553 -179.762 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -75.57 124.08 26.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.238 0.542 . . . . 0.0 111.553 -178.371 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.493 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 59.0 t80 -128.05 136.48 51.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.623 179.683 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 59.6 m -103.82 139.99 38.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.815 179.777 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.581 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -58.06 137.09 57.19 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.891 -179.937 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -86.72 -3.77 59.09 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.234 178.486 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.452 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . 81.5 mm-40 -143.07 162.64 34.97 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.857 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -71.93 -19.67 61.87 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.706 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -89.21 -10.67 46.16 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -179.506 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.581 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 1.1 mt-10 -83.33 179.54 7.66 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.036 0.446 . . . . 0.0 110.247 179.817 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.797 HD21 ' HB2' ' A' ' 43' ' ' ASN . 15.9 tp -122.84 128.49 50.45 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.914 -178.394 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -71.76 147.62 47.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.41 179.729 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.493 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 40.1 pt -132.23 161.87 40.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.761 179.461 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 99.0 mttt -117.67 163.09 16.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.073 0.464 . . . . 0.0 111.226 -179.87 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.472 ' HA ' ' C ' ' A' ' 11' ' ' TRP . 55.4 pttt -64.18 -12.17 37.79 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -179.667 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -138.84 22.94 2.65 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.942 179.355 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.479 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 51.6 tp10 -100.12 140.93 33.64 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.105 0.478 . . . . 0.0 111.219 -179.884 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.441 ' C ' HD22 ' A' ' 29' ' ' LEU . 61.2 mtt85 -91.94 122.43 34.45 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.704 -179.852 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.694 ' HB3' HG21 ' A' ' 41' ' ' VAL . 2.4 mm? -115.29 145.31 42.6 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.612 -178.386 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.44 ' CD1' HG12 ' A' ' 6' ' ' ILE . 6.3 m0 -101.65 107.63 18.94 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.547 179.648 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.437 ' HA ' HG23 ' A' ' 41' ' ' VAL . 92.9 mt -79.18 148.83 32.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.342 0.591 . . . . 0.0 112.146 -179.205 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' A' ' 41' ' ' VAL . 4.9 mp -112.06 -28.96 7.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.486 179.181 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -161.05 118.08 2.31 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.264 179.496 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.504 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 33.6 p-10 -113.22 11.76 18.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.111 -179.472 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 83.2 p -71.21 -37.87 72.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.913 0.387 . . . . 0.0 111.288 -179.678 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.07 160.95 20.84 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.411 0.624 . . . . 0.0 112.344 -179.269 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 36.5 p -55.3 -40.37 71.01 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.061 178.002 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.553 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 50.7 m95 -92.39 132.67 36.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.4 -1.273 . . . . 0.0 108.819 177.812 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.504 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -106.84 138.67 42.58 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -178.054 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.482 ' HG2' HD13 ' A' ' 32' ' ' LEU . 56.2 ttt180 -96.1 129.08 43.48 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.161 177.867 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.694 HG21 ' HB3' ' A' ' 29' ' ' LEU . 1.4 p -141.74 159.23 21.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -177.987 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.45 ' CB ' HG22 ' A' ' 48' ' ' THR . 71.3 ttt180 -124.07 141.87 51.68 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.289 -179.627 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.797 ' HB2' HD21 ' A' ' 21' ' ' LEU . 48.7 t30 -110.12 162.69 14.32 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-O 120.985 0.422 . . . . 0.0 111.021 179.281 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.01 -19.32 51.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.922 178.608 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.56 5.59 8.79 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.027 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 66.56 26.96 9.76 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.165 0.507 . . . . 0.0 111.105 -179.455 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.458 ' O ' HD13 ' A' ' 21' ' ' LEU . 57.3 ttm-85 -113.79 125.32 53.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.822 178.957 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.45 HG22 ' CB ' ' A' ' 42' ' ' ARG . 77.6 p -118.51 143.59 46.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.936 0.398 . . . . 0.0 111.554 -179.221 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.562 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -161.06 172.01 37.23 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.75 179.961 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.478 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 95.7 m-85 -104.71 107.87 19.04 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 117.019 0.409 . . . . 0.0 111.995 -179.432 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.517 HG11 ' O ' ' A' ' 21' ' ' LEU . 11.4 m -122.75 120.12 27.85 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.305 178.744 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.553 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 61.7 Cg_endo -73.54 31.59 0.32 Allowed 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.39 2.06 . . . . 0.0 112.542 178.484 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 86.4 p -61.72 93.95 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 120.997 0.427 . . . . 0.0 111.178 -179.641 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -78.6 -4.85 50.93 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.593 178.321 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.706 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 86.1 m-85 -72.18 -9.77 58.89 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.405 179.22 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.581 HG23 ' C ' ' A' ' 8' ' ' ILE . 6.9 p -120.2 139.71 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 121.187 0.518 . . . . 0.0 110.614 -179.819 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -144.1 160.21 41.29 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.072 179.88 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.794 ' CA ' HG12 ' A' ' 7' ' ' VAL . 77.9 ttt-85 -69.4 138.57 53.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.928 0.394 . . . . 0.0 110.919 -179.688 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.55 ' HD2' HD12 ' A' ' 8' ' ' ILE . 95.2 mttt . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.839 -179.901 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.1 mtm . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.901 0.382 . . . . 0.0 111.371 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.5 p -79.14 152.37 30.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.945 0.402 . . . . 0.0 111.068 179.96 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -99.22 138.14 36.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.876 179.819 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -97.94 138.64 34.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.165 0.507 . . . . 0.0 111.194 -179.89 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.479 ' HB ' ' HB2' ' A' ' 31' ' ' LEU . 61.0 t -114.4 130.1 69.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.239 179.781 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.43 HG23 ' CD1' ' A' ' 30' ' ' TRP . 8.4 mt -109.88 117.02 53.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.388 -179.743 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.712 HG12 ' CA ' ' A' ' 58' ' ' ARG . 33.1 m -131.94 160.35 42.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.831 0.348 . . . . 0.0 111.157 179.466 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.678 HG23 ' HG2' ' A' ' 28' ' ' ARG . 21.4 mt -117.63 126.66 74.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.844 179.735 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.545 ' HA ' HG23 ' A' ' 56' ' ' VAL . . . -74.79 149.68 39.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.147 0.498 . . . . 0.0 110.867 -179.885 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -112.02 -21.43 11.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.948 179.87 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.503 ' HB2' ' HB3' ' A' ' 55' ' ' TYR . 20.3 m-90 -139.26 151.3 46.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.838 179.991 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.509 ' HB2' ' HG2' ' A' ' 25' ' ' LYS . 57.1 t0 -74.59 125.45 28.67 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.07 0.462 . . . . 0.0 111.196 -178.761 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.488 ' HB3' ' CG1' ' A' ' 23' ' ' ILE . 61.2 t80 -128.08 137.5 52.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.942 179.813 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.8 t -103.49 139.28 39.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.651 179.784 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.841 ' HB1' ' HB2' ' A' ' 20' ' ' GLU . . . -57.19 129.81 43.41 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.42 -179.935 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.416 ' HG2' ' OH ' ' A' ' 13' ' ' TYR . 95.2 mm-40 -62.85 -33.46 75.3 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.308 0.575 . . . . 0.0 110.186 179.471 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -131.39 161.67 31.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.205 179.739 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -62.03 -33.9 75.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.084 0.469 . . . . 0.0 111.288 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -65.87 -20.16 66.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.202 179.888 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.841 ' HB2' ' HB1' ' A' ' 15' ' ' ALA . 2.8 mm-40 -83.32 179.24 7.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 0.0 110.979 -179.663 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.826 HD21 ' HB3' ' A' ' 43' ' ' ASN . 39.8 tp -121.7 126.06 48.09 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.893 -178.547 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -73.18 159.07 34.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.804 179.314 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.488 ' CG1' ' HB3' ' A' ' 13' ' ' TYR . 41.5 pt -141.83 166.87 16.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.366 179.807 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.486 ' HB2' ' HB2' ' A' ' 27' ' ' GLU . 57.1 mttm -114.48 178.67 4.2 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.215 0.531 . . . . 0.0 111.524 -179.722 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.509 ' HG2' ' HB2' ' A' ' 12' ' ' ASP . 20.6 mttp -61.49 -52.31 65.03 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.234 -179.543 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -107.13 -1.36 22.04 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -178.097 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.486 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 79.5 tt0 -62.89 144.43 56.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.233 0.539 . . . . 0.0 111.205 -179.541 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.678 ' HG2' HG23 ' A' ' 8' ' ' ILE . 75.5 mtp180 -100.36 120.82 40.53 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.313 -179.984 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.684 ' HB3' HG21 ' A' ' 41' ' ' VAL . 1.2 mm? -111.65 149.37 31.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.549 -178.758 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.462 ' C ' HG23 ' A' ' 41' ' ' VAL . 5.2 m-90 -103.91 107.73 18.75 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.126 179.709 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.479 ' HB2' ' HB ' ' A' ' 5' ' ' VAL . 88.0 mt -76.23 147.68 38.18 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.031 0.443 . . . . 0.0 111.996 -179.172 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 41' ' ' VAL . 5.2 mp -109.8 -28.93 8.54 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.596 179.482 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -160.97 117.71 2.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.69 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.522 ' HB2' ' CZ2' ' A' ' 39' ' ' TRP . 34.5 p-10 -110.53 3.04 19.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.132 -179.558 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.6 m -63.96 -38.4 90.93 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.772 0.32 . . . . 0.0 111.61 -179.735 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.69 162.76 19.57 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.331 0.586 . . . . 0.0 112.506 -179.075 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.456 ' HG1' ' HD1' ' A' ' 38' ' ' TRP . 19.6 p -58.94 -37.23 76.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.244 178.291 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.635 ' CE3' ' HD3' ' A' ' 52' ' ' PRO . 68.6 m95 -94.77 131.05 41.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.579 -1.191 . . . . 0.0 108.525 177.959 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.522 ' CZ2' ' HB2' ' A' ' 34' ' ' ASP . 37.7 m0 -105.44 137.08 43.84 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.492 ' HB2' ' CE2' ' A' ' 50' ' ' TYR . 69.2 ttt180 -94.61 129.9 41.27 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 178.048 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.778 HG13 HD23 ' A' ' 21' ' ' LEU . 2.4 p -143.29 155.1 16.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 C-N-CA 120.382 -0.527 . . . . 0.0 112.155 -178.384 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.707 ' HG3' HG22 ' A' ' 48' ' ' THR . 28.4 ttp-105 -123.74 142.2 51.31 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.912 -179.613 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.826 ' HB3' HD21 ' A' ' 21' ' ' LEU . 43.6 p-10 -111.65 171.66 7.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.676 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.5 -26.72 68.69 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.381 -179.978 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.468 ' HB3' HD21 ' A' ' 43' ' ' ASN . . . -71.37 5.4 2.3 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 179.451 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 66.57 25.14 10.08 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.092 0.472 . . . . 0.0 111.026 -179.404 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.9 ttm180 -110.32 127.8 55.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.598 178.945 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.707 HG22 ' HG3' ' A' ' 42' ' ' ARG . 11.8 p -121.79 145.63 47.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.724 0.297 . . . . 0.0 110.878 -179.344 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.484 ' HA3' ' HA ' ' A' ' 20' ' ' GLU . . . -164.92 170.46 39.99 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.996 179.73 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.492 ' CE2' ' HB2' ' A' ' 40' ' ' ARG . 90.6 m-85 -101.56 112.45 25.01 Favored 'General case' 0 C--O 1.231 0.104 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -179.436 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.585 HG13 ' HB3' ' A' ' 20' ' ' GLU . 15.8 m -135.22 116.09 12.05 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.59 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.635 ' HD3' ' CE3' ' A' ' 38' ' ' TRP . 63.2 Cg_endo -73.09 45.44 0.95 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.384 2.056 . . . . 0.0 111.903 179.044 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.536 ' O ' HG12 ' A' ' 56' ' ' VAL . 1.6 p -70.21 85.22 0.56 Allowed 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.792 -179.663 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -63.9 -14.6 54.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.008 0.432 . . . . 0.0 110.443 178.724 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.503 ' HB3' ' HB2' ' A' ' 11' ' ' TRP . 94.4 m-85 -61.32 -14.6 28.24 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.624 179.367 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.66 HG23 ' C ' ' A' ' 8' ' ' ILE . 7.3 p -118.23 140.03 43.19 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 CA-C-O 121.182 0.515 . . . . 0.0 111.201 179.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -145.5 159.13 43.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.381 179.676 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.712 ' CA ' HG12 ' A' ' 7' ' ' VAL . 80.5 ttt180 -71.0 135.2 47.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.839 0.352 . . . . 0.0 110.842 179.912 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.054 179.656 . . . . . . . . 0 0 . 1 stop_ save_